N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide

C19H25N5O3 — CID 92635517

IUPACN-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
SMILESCc1c([C@@H](C)NC(=O)Cn2cccc(C(=O)NCC3CC3)c2=O)cnn1C
InChIInChI=1S/C19H25N5O3/c1-12(16-10-21-23(3)13(16)2)22-17(25)11-24-8-4-5-15(19(24)27)18(26)20-9-14-6-7-14/h4-5,8,10,12,14H,6-7,9,11H2,1-3H3,(H,20,26)(H,22,25)/t12-/m1/s1
InChIKeySDUCKVQJXOUURV-GFCCVEGCSA-N
MW371.44 g/mol
LogP0.91
Rot. Bonds7

About N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide

N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide (PubChem CID 92635517) has the molecular formula C19H25N5O3 and a molecular weight of 371.44 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
PubChem CID92635517
Molecular FormulaC19H25N5O3
Molecular Weight371.44 g/mol
Exact Mass371.20
IUPAC NameN-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide
SMILESCc1c([C@@H](C)NC(=O)Cn2cccc(C(=O)NCC3CC3)c2=O)cnn1C
InChIInChI=1S/C19H25N5O3/c1-12(16-10-21-23(3)13(16)2)22-17(25)11-24-8-4-5-15(19(24)27)18(26)20-9-14-6-7-14/h4-5,8,10,12,14H,6-7,9,11H2,1-3H3,(H,20,26)(H,22,25)/t12-/m1/s1
InChIKeySDUCKVQJXOUURV-GFCCVEGCSA-N
XLogP0.91
TPSA98.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide (CID 92635517) is N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide is Cc1c([C@@H](C)NC(=O)Cn2cccc(C(=O)NCC3CC3)c2=O)cnn1C.
What is the InChIKey of N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
The InChIKey is SDUCKVQJXOUURV-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H25N5O3/c1-12(16-10-21-23(3)13(16)2)22-17(25)11-24-8-4-5-15(19(24)27)18(26)20-9-14-6-7-14/h4-5,8,10,12,14H,6-7,9,11H2,1-3H3,(H,20,26)(H,22,25)/t12-/m1/s1.
What are the key properties of N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide?
N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide has a molecular weight of 371.44 g/mol, XLogP of 0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-[2-[[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]amino]-2-oxoethyl]-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 92635517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).