N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide

C16H28N4O — CID 119734124

IUPACN-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide
SMILESCC(CNC(=O)CC(C)C1CCCNC1)Cn1cccn1
InChIInChI=1S/C16H28N4O/c1-13(12-20-8-4-7-19-20)10-18-16(21)9-14(2)15-5-3-6-17-11-15/h4,7-8,13-15,17H,3,5-6,9-12H2,1-2H3,(H,18,21)
InChIKeyCZLVHESBTPMJFJ-UHFFFAOYSA-N
MW292.43 g/mol
LogP1.66
Rot. Bonds7

About N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide

N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide (PubChem CID 119734124) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide.

Molecular Properties

Compound NameN-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide
PubChem CID119734124
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC NameN-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide
SMILESCC(CNC(=O)CC(C)C1CCCNC1)Cn1cccn1
InChIInChI=1S/C16H28N4O/c1-13(12-20-8-4-7-19-20)10-18-16(21)9-14(2)15-5-3-6-17-11-15/h4,7-8,13-15,17H,3,5-6,9-12H2,1-2H3,(H,18,21)
InChIKeyCZLVHESBTPMJFJ-UHFFFAOYSA-N
XLogP1.66
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methylbutyl)-3-piperidin-3-ylbutanamide
CID 81043770
N-(2-methyl-3-pyrazol-1-ylpropyl)piperidine-3-carboxamide;hydrochloride
CID 119295241
N-(2-methyl-3-morpholin-4-ylpropyl)-3-piperidin-3-ylbutanamide
CID 119869012
N-(2-methyl-3-pyrazol-1-ylpropyl)-4-piperidin-3-ylbenzamide
CID 167866370
N-(2-ethoxypropyl)-3-piperidin-3-ylbutanamide
CID 115739458
N-(1-imidazol-1-ylpropan-2-yl)-3-piperidin-3-ylbutanamide
CID 81044808
N-[2-(2-methylpropanoylamino)ethyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119687970
N-(2-ethylsulfonylethyl)-3-piperidin-3-ylbutanamide;hydrochloride
CID 119773434
3-piperidin-3-yl-N-pyrimidin-2-ylbutanamide
CID 81043820
N-butyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119671850
3-piperidin-3-yl-N-(pyridin-2-ylmethyl)butanamide
CID 81043996
N-[2-(4-ethylpiperazin-1-yl)propyl]-3-piperidin-3-ylbutanamide;trihydrochloride
CID 119901725

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide?
The IUPAC name of N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide (CID 119734124) is N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide.
What is the SMILES notation for N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide?
The canonical SMILES for N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide is CC(CNC(=O)CC(C)C1CCCNC1)Cn1cccn1.
What is the InChIKey of N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide?
The InChIKey is CZLVHESBTPMJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-13(12-20-8-4-7-19-20)10-18-16(21)9-14(2)15-5-3-6-17-11-15/h4,7-8,13-15,17H,3,5-6,9-12H2,1-2H3,(H,18,21).
What are the key properties of N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide?
N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide has a molecular weight of 292.43 g/mol, XLogP of 1.66, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyrazol-1-ylpropyl)-3-piperidin-3-ylbutanamide is sourced from PubChem (CID 119734124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).