N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide

C15H17N5O — CID 166300242

IUPACN-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide
SMILESO=C(NCC1[C@H]2CNC[C@@H]12)c1[nH]ncc1-c1ccncc1
InChIInChI=1S/C15H17N5O/c21-15(18-7-13-11-5-17-6-12(11)13)14-10(8-19-20-14)9-1-3-16-4-2-9/h1-4,8,11-13,17H,5-7H2,(H,18,21)(H,19,20)/t11-,12+,13?
InChIKeyOLFBJWKOSKPJHH-FUNVUKJBSA-N
MW283.33 g/mol
LogP0.67
Rot. Bonds4

About N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide

N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide (PubChem CID 166300242) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide
PubChem CID166300242
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC NameN-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide
SMILESO=C(NCC1[C@H]2CNC[C@@H]12)c1[nH]ncc1-c1ccncc1
InChIInChI=1S/C15H17N5O/c21-15(18-7-13-11-5-17-6-12(11)13)14-10(8-19-20-14)9-1-3-16-4-2-9/h1-4,8,11-13,17H,5-7H2,(H,18,21)(H,19,20)/t11-,12+,13?
InChIKeyOLFBJWKOSKPJHH-FUNVUKJBSA-N
XLogP0.67
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide with MolForge

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Related Compounds

3-[2-[(4-pyridin-4-yl-1H-pyrazole-5-carbonyl)amino]ethyldisulfanyl]propanoic acid;2,2,2-trifluoroacetic acid
CID 166425022
N-(2-aminoethyl)-4-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
CID 19768638
tert-butyl-[2-[[4-(4-fluorophenyl)-1H-pyrazole-5-carbonyl]amino]ethyl]carbamic acid
CID 70365466
3-fluoro-N-[[4-(4-pyridin-4-yl-1H-pyrazol-5-yl)cyclohexyl]methyl]benzamide
CID 98135026
4-amino-N-(pyridin-4-ylmethyl)-1H-pyrazole-5-carboxamide
CID 63107423
2-(4-methylphenyl)-N-[[4-(4-pyridin-4-yl-1H-pyrazol-5-yl)cyclohexyl]methyl]acetamide
CID 98134976
1-methyl-6-oxo-N-[[4-(4-pyridin-4-yl-1H-pyrazol-5-yl)cyclohexyl]methyl]pyridazine-3-carboxamide
CID 98135028
N-(piperidin-3-ylmethyl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119460276
N-propyl-3-(4-pyridin-4-yl-1H-pyrazol-5-yl)benzamide
CID 58302750
[(2S)-oxiran-2-yl]-(4-phenyl-1H-pyrazol-5-yl)methanone
CID 915494
N-(piperidin-4-ylmethyl)pyridine-4-carboxamide chloride
CID 53312688
N-(azetidin-3-ylmethyl)pyrazine-2-carboxamide
CID 127017038

Frequently Asked Questions

What is the IUPAC name of N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide?
The IUPAC name of N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide (CID 166300242) is N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide is O=C(NCC1[C@H]2CNC[C@@H]12)c1[nH]ncc1-c1ccncc1.
What is the InChIKey of N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide?
The InChIKey is OLFBJWKOSKPJHH-FUNVUKJBSA-N. The full InChI is InChI=1S/C15H17N5O/c21-15(18-7-13-11-5-17-6-12(11)13)14-10(8-19-20-14)9-1-3-16-4-2-9/h1-4,8,11-13,17H,5-7H2,(H,18,21)(H,19,20)/t11-,12+,13?.
What are the key properties of N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide?
N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 0.67, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(1R,5S)-3-azabicyclo[3.1.0]hexan-6-yl]methyl]-4-pyridin-4-yl-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 166300242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).