N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

C17H24N6O — CID 138031289

IUPACN-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCN1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)C2)CC1
InChIInChI=1S/C17H24N6O/c1-21-8-4-14(5-9-21)22-10-3-13(12-22)19-17(24)15-11-16-18-6-2-7-23(16)20-15/h2,6-7,11,13-14H,3-5,8-10,12H2,1H3,(H,19,24)
InChIKeySIYLISLMQBPPSJ-UHFFFAOYSA-N
MW328.42 g/mol
LogP0.63
Rot. Bonds3

About N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide

N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 138031289) has the molecular formula C17H24N6O and a molecular weight of 328.42 g/mol. Its IUPAC name is N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID138031289
Molecular FormulaC17H24N6O
Molecular Weight328.42 g/mol
Exact Mass328.20
IUPAC NameN-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCN1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)C2)CC1
InChIInChI=1S/C17H24N6O/c1-21-8-4-14(5-9-21)22-10-3-13(12-22)19-17(24)15-11-16-18-6-2-7-23(16)20-15/h2,6-7,11,13-14H,3-5,8-10,12H2,1H3,(H,19,24)
InChIKeySIYLISLMQBPPSJ-UHFFFAOYSA-N
XLogP0.63
TPSA65.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(1,2,4-triazol-1-yl)cyclohexyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 176501532
3-ethoxy-4-methyl-N-[(3S)-1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]benzamide
CID 171357990
N-[3-(1H-imidazol-2-yl)cyclobutyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 166281654
5-methyl-N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]-1H-pyrazole-3-carboxamide
CID 45233020
N-[2-[(3S)-3-(2-methylphenyl)pyrrolidin-1-yl]ethyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 124757330
N-[(3R)-1-methylpyrrolidin-3-yl]pyridine-2-carboxamide
CID 59568965
N-[(2S,3aS)-10,10-dioxo-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-b][5,1,2]benzoxathiazepin-2-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 146038170
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 81317228
N-[3-[5-[(dimethylamino)methyl]-4-methyl-1,2,4-triazol-3-yl]cyclobutyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide;hydrochloride
CID 154902517
N-(1-cyclopropylpyrrolidin-3-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374989
3-acetyl-N-[(3R)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]-1H-pyrazole-5-carboxamide
CID 29028354
N-(1-methylpiperidin-4-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 138031289) is N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is CN1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)C2)CC1.
What is the InChIKey of N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is SIYLISLMQBPPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O/c1-21-8-4-14(5-9-21)22-10-3-13(12-22)19-17(24)15-11-16-18-6-2-7-23(16)20-15/h2,6-7,11,13-14H,3-5,8-10,12H2,1H3,(H,19,24).
What are the key properties of N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide?
N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-methylpiperidin-4-yl)pyrrolidin-3-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 138031289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).