N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide

C17H29N5O2 — CID 120941182

IUPACN-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(NC(=O)C1(n2cccn2)CCNCC1)C(C)N1CCOCC1
InChIInChI=1S/C17H29N5O2/c1-14(15(2)21-10-12-24-13-11-21)20-16(23)17(4-7-18-8-5-17)22-9-3-6-19-22/h3,6,9,14-15,18H,4-5,7-8,10-13H2,1-2H3,(H,20,23)
InChIKeyCSPBTKLJORWYED-UHFFFAOYSA-N
MW335.45 g/mol
LogP0.19
Rot. Bonds5

About N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide

N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide (PubChem CID 120941182) has the molecular formula C17H29N5O2 and a molecular weight of 335.45 g/mol. Its IUPAC name is N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide
PubChem CID120941182
Molecular FormulaC17H29N5O2
Molecular Weight335.45 g/mol
Exact Mass335.23
IUPAC NameN-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide
SMILESCC(NC(=O)C1(n2cccn2)CCNCC1)C(C)N1CCOCC1
InChIInChI=1S/C17H29N5O2/c1-14(15(2)21-10-12-24-13-11-21)20-16(23)17(4-7-18-8-5-17)22-9-3-6-19-22/h3,6,9,14-15,18H,4-5,7-8,10-13H2,1-2H3,(H,20,23)
InChIKeyCSPBTKLJORWYED-UHFFFAOYSA-N
XLogP0.19
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-cyclopropylethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120919574
N-(2-morpholin-4-ylethyl)-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120937758
morpholin-4-yl-(4-pyrazol-1-ylpiperidin-4-yl)methanone;hydrochloride
CID 120917128
N-[1-(2-methoxyphenyl)ethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120918589
N-[3-oxo-3-(propan-2-ylamino)propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120921332
N-[1-(4-ethylphenyl)ethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120918940
N-[2-(dimethylamino)propyl]-4-pyrazol-1-ylpiperidine-4-carboxamide
CID 120939947
methyl 2-(oxan-4-yl)-3-[(4-pyrazol-1-ylpiperidine-4-carbonyl)amino]propanoate
CID 120931889
N-[1-(1-benzothiophen-2-yl)ethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120931578
N-[1-(2-methylphenyl)propan-2-yl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120926238
N-[1-(3,4-dimethylphenyl)ethyl]-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
CID 120923777
4-pyrazol-1-yl-N-[(1R)-1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethyl]piperidine-4-carboxamide;dihydrochloride
CID 120938497

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The IUPAC name of N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide (CID 120941182) is N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide is CC(NC(=O)C1(n2cccn2)CCNCC1)C(C)N1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
The InChIKey is CSPBTKLJORWYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O2/c1-14(15(2)21-10-12-24-13-11-21)20-16(23)17(4-7-18-8-5-17)22-9-3-6-19-22/h3,6,9,14-15,18H,4-5,7-8,10-13H2,1-2H3,(H,20,23).
What are the key properties of N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide?
N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylbutan-2-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide is sourced from PubChem (CID 120941182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).