N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide

C15H24N4O — CID 47151884

IUPACN-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESCCC(CC)NC(=O)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H24N4O/c1-3-13(4-2)17-15(20)19-11-9-18(10-12-19)14-7-5-6-8-16-14/h5-8,13H,3-4,9-12H2,1-2H3,(H,17,20)
InChIKeyCUIPLBPGTKCCIG-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.10
Rot. Bonds4

About N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide

N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide (PubChem CID 47151884) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide
PubChem CID47151884
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESCCC(CC)NC(=O)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H24N4O/c1-3-13(4-2)17-15(20)19-11-9-18(10-12-19)14-7-5-6-8-16-14/h5-8,13H,3-4,9-12H2,1-2H3,(H,17,20)
InChIKeyCUIPLBPGTKCCIG-UHFFFAOYSA-N
XLogP2.10
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-phenylethyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108988786
N-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]propanamide
CID 47411908
1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 18714915
2-methyl-N-[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]butanamide
CID 51100747
N-butan-2-yl-4-(4-pyridin-2-ylpiperazine-1-carbonyl)benzamide
CID 109044082
2-(methylamino)-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone;hydrochloride
CID 120703285
N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 735809
N-[1-(4-hydroxyphenoxy)ethyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108871232
3-(propan-2-ylamino)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 60854319
(2S)-2-hydroxy-3-[(4-pyridin-2-ylpiperazine-1-carbonyl)amino]propanoic acid
CID 107838022
N-[1-oxo-1-(4-pyridin-2-ylpiperazin-1-yl)propan-2-yl]butanamide
CID 53161580
3-(pentylamino)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one
CID 109030233

Frequently Asked Questions

What is the IUPAC name of N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide (CID 47151884) is N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide is CCC(CC)NC(=O)N1CCN(c2ccccn2)CC1.
What is the InChIKey of N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide?
The InChIKey is CUIPLBPGTKCCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-13(4-2)17-15(20)19-11-9-18(10-12-19)14-7-5-6-8-16-14/h5-8,13H,3-4,9-12H2,1-2H3,(H,17,20).
What are the key properties of N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide?
N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-3-yl-4-pyridin-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 47151884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).