N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide

C14H28N2O3 — CID 103920724

IUPACN-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide
SMILESCC(C)CC(O)CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C14H28N2O3/c1-11(2)9-12(17)10-16-14(18)5-8-19-13-3-6-15-7-4-13/h11-13,15,17H,3-10H2,1-2H3,(H,16,18)
InChIKeyNQHNCQGTTGZCNI-UHFFFAOYSA-N
MW272.39 g/mol
LogP0.67
Rot. Bonds8

About N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide

N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide (PubChem CID 103920724) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide
PubChem CID103920724
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC NameN-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide
SMILESCC(C)CC(O)CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C14H28N2O3/c1-11(2)9-12(17)10-16-14(18)5-8-19-13-3-6-15-7-4-13/h11-13,15,17H,3-10H2,1-2H3,(H,16,18)
InChIKeyNQHNCQGTTGZCNI-UHFFFAOYSA-N
XLogP0.67
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dimethylbutyl)-3-piperidin-4-yloxypropanamide
CID 64599298
3-piperidin-4-yloxy-N-(3,3,3-trifluoro-2-hydroxypropyl)propanamide
CID 103920690
N-[2-(2-hydroxyethyl)pentyl]-3-piperidin-4-yloxypropanamide
CID 106116784
2-methyl-N-[2-(3-piperidin-4-yloxypropanoylamino)ethyl]propanamide
CID 63904487
2-methoxy-3-(3-piperidin-4-yloxypropanoylamino)propanoic acid
CID 106108800
3-piperidin-4-yloxy-N-(2-piperidin-1-ylpropyl)propanamide
CID 63877201
(2S)-4-methyl-2-(3-piperidin-4-yloxypropanoylamino)pentanoic acid
CID 78953665
N-(2-ethylhexyl)-3-piperidin-4-yloxypropanamide
CID 63904485
N-(2-amino-2-oxoethyl)-3-piperidin-4-yloxypropanamide
CID 63875429
N-[2-(dimethylamino)-2-oxoethyl]-3-piperidin-4-yloxypropanamide
CID 63874940
3-piperidin-4-yloxy-N-prop-2-enylpropanamide
CID 63875272
3-methyl-2-(3-piperidin-4-yloxypropanoylamino)butanamide
CID 103920702

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide (CID 103920724) is N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide is CC(C)CC(O)CNC(=O)CCOC1CCNCC1.
What is the InChIKey of N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide?
The InChIKey is NQHNCQGTTGZCNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-11(2)9-12(17)10-16-14(18)5-8-19-13-3-6-15-7-4-13/h11-13,15,17H,3-10H2,1-2H3,(H,16,18).
What are the key properties of N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide?
N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide has a molecular weight of 272.39 g/mol, XLogP of 0.67, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-methylpentyl)-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 103920724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).