N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide

C14H28N2O2 — CID 113376268

IUPACN-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)NC(C)CC(C)O)CCCNC1
InChIInChI=1S/C14H28N2O2/c1-4-6-14(7-5-8-15-10-14)13(18)16-11(2)9-12(3)17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyNSRNGVDGYHIJQI-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.43
Rot. Bonds6

About N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide

N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide (PubChem CID 113376268) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide
PubChem CID113376268
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide
SMILESCCCC1(C(=O)NC(C)CC(C)O)CCCNC1
InChIInChI=1S/C14H28N2O2/c1-4-6-14(7-5-8-15-10-14)13(18)16-11(2)9-12(3)17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18)
InChIKeyNSRNGVDGYHIJQI-UHFFFAOYSA-N
XLogP1.43
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylsulfonylpropan-2-yl)-3-propylpiperidine-3-carboxamide
CID 64642823
N-(3-hydroxybutyl)-3-propylpiperidine-3-carboxamide
CID 64913722
methyl 4-methyl-2-[(3-propylpiperidine-3-carbonyl)amino]pentanoate
CID 63129989
methyl 3-methyl-2-[(3-propylpiperidine-3-carbonyl)amino]pentanoate
CID 63130841
2-hydroxy-3-[(3-propylpiperidine-3-carbonyl)amino]propanoic acid
CID 66168018
(2R)-4-amino-4-oxo-2-[(3-propylpiperidine-3-carbonyl)amino]butanoic acid
CID 107824549
N-(2,2-difluoroethyl)-3-propylpiperidine-3-carboxamide
CID 115406882
3-ethyl-N-heptan-2-ylpiperidine-3-carboxamide
CID 63130413
(2S)-2-hydroxy-4-[(3-propylpiperidine-3-carbonyl)amino]butanoic acid
CID 107836459
methyl 3-propylpiperidine-3-carboxylate
CID 56773807
2-methyl-2-[(3-propylpiperidine-3-carbonyl)amino]butanoic acid
CID 79799194
N-[(1R)-2-hydroxy-1-phenylethyl]-3-propylpiperidine-3-carboxamide
CID 107863291

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide?
The IUPAC name of N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide (CID 113376268) is N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide.
What is the SMILES notation for N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide?
The canonical SMILES for N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide is CCCC1(C(=O)NC(C)CC(C)O)CCCNC1.
What is the InChIKey of N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide?
The InChIKey is NSRNGVDGYHIJQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-6-14(7-5-8-15-10-14)13(18)16-11(2)9-12(3)17/h11-12,15,17H,4-10H2,1-3H3,(H,16,18).
What are the key properties of N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide?
N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide has a molecular weight of 256.39 g/mol, XLogP of 1.43, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxypentan-2-yl)-3-propylpiperidine-3-carboxamide is sourced from PubChem (CID 113376268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).