N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C19H23N7O2 — CID 146115665

IUPACN-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCO[C@H]1C[C@@H](CNC(=O)c2cnn3ccc(C)nc23)N(c2cc(C)ncn2)C1
InChIInChI=1S/C19H23N7O2/c1-12-4-5-26-18(24-12)16(9-23-26)19(27)20-8-14-7-15(28-3)10-25(14)17-6-13(2)21-11-22-17/h4-6,9,11,14-15H,7-8,10H2,1-3H3,(H,20,27)/t14-,15-/m0/s1
InChIKeyMIDYQAPELWBNDE-GJZGRUSLSA-N
MW381.44 g/mol
LogP1.16
Rot. Bonds5

About N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 146115665) has the molecular formula C19H23N7O2 and a molecular weight of 381.44 g/mol. Its IUPAC name is N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID146115665
Molecular FormulaC19H23N7O2
Molecular Weight381.44 g/mol
Exact Mass381.19
IUPAC NameN-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCO[C@H]1C[C@@H](CNC(=O)c2cnn3ccc(C)nc23)N(c2cc(C)ncn2)C1
InChIInChI=1S/C19H23N7O2/c1-12-4-5-26-18(24-12)16(9-23-26)19(27)20-8-14-7-15(28-3)10-25(14)17-6-13(2)21-11-22-17/h4-6,9,11,14-15H,7-8,10H2,1-3H3,(H,20,27)/t14-,15-/m0/s1
InChIKeyMIDYQAPELWBNDE-GJZGRUSLSA-N
XLogP1.16
TPSA97.54 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.44
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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Related Compounds

8-hydroxy-N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]naphthalene-1-carboxamide
CID 146115761
3-chloro-N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-2-methylbenzamide
CID 146115669
5-methyl-N-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 119512184
5-methyl-N-[[(2R)-1-(2-phenylethyl)pyrrolidin-2-yl]methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 124873073
2,2-dimethyl-3-[(5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]propanoic acid
CID 119249566
N-[(1S,3R)-3-[(4-ethoxy-6-oxopyran-2-carbonyl)amino]cyclopentyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166348597
N-[cyclopropyl-(6-methoxy-3-pyridinyl)methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136555676
5-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136512225
5-[(2R)-2-(5-fluoro-2-methoxy-3-pyridinyl)pyrrolidin-1-yl]-N-(3-hydroxypropyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 67471053
N-(3-chloro-2-oxopropyl)-5-[(2R)-2-(5-fluoro-2-methoxy-3-pyridinyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 86691729
3-methyl-2-[(5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]pentanoic acid
CID 119211732
5-methyl-N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136525893

Frequently Asked Questions

What is the IUPAC name of N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 146115665) is N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CO[C@H]1C[C@@H](CNC(=O)c2cnn3ccc(C)nc23)N(c2cc(C)ncn2)C1.
What is the InChIKey of N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is MIDYQAPELWBNDE-GJZGRUSLSA-N. The full InChI is InChI=1S/C19H23N7O2/c1-12-4-5-26-18(24-12)16(9-23-26)19(27)20-8-14-7-15(28-3)10-25(14)17-6-13(2)21-11-22-17/h4-6,9,11,14-15H,7-8,10H2,1-3H3,(H,20,27)/t14-,15-/m0/s1.
What are the key properties of N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 381.44 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2S,4S)-4-methoxy-1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]methyl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 146115665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).