4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide

C15H30N2O2 — CID 110894480

IUPAC4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide
SMILESCC(C)CCCC(C)NC(=O)N1CCC(CO)CC1
InChIInChI=1S/C15H30N2O2/c1-12(2)5-4-6-13(3)16-15(19)17-9-7-14(11-18)8-10-17/h12-14,18H,4-11H2,1-3H3,(H,16,19)
InChIKeyLYYHANNTJVTQDY-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.62
Rot. Bonds6

About 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide

4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide (PubChem CID 110894480) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide
PubChem CID110894480
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide
SMILESCC(C)CCCC(C)NC(=O)N1CCC(CO)CC1
InChIInChI=1S/C15H30N2O2/c1-12(2)5-4-6-13(3)16-15(19)17-9-7-14(11-18)8-10-17/h12-14,18H,4-11H2,1-3H3,(H,16,19)
InChIKeyLYYHANNTJVTQDY-UHFFFAOYSA-N
XLogP2.62
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(hydroxymethyl)-N-(5-methylhexan-2-yl)pyrrolidine-1-carboxamide
CID 111443461
3-(hydroxymethyl)-N-(1-methylsulfanylpropan-2-yl)pyrrolidine-1-carboxamide
CID 111444197
3-(hydroxymethyl)-N-(4-methylpentyl)pyrrolidine-1-carboxamide
CID 111443668
N-(1-cyclohexylethyl)-4-(hydroxymethyl)piperidine-1-carboxamide
CID 111507122
(2R)-2-[[4-(hydroxymethyl)piperidine-1-carbonyl]amino]pentanoic acid
CID 107566112
N-(3-cyclohexylbutan-2-yl)-4-(hydroxymethyl)piperidine-1-carboxamide
CID 111722585
4-(hydroxymethyl)-N-[4-(4-propan-2-yloxyphenyl)butan-2-yl]piperidine-1-carboxamide
CID 110901487
2-[[4-(hydroxymethyl)piperidine-1-carbonyl]amino]-5-methoxypentanoic acid
CID 81084930
N-[(2S)-1-hydroxypropan-2-yl]-4-methylpiperidine-1-carboxamide
CID 79159288
4-(hydroxymethyl)-N-methylazepane-1-carboxamide
CID 130892258
N-(6-methylheptan-2-yl)-4-(2-methylpyrimidin-4-yl)piperidine-1-carboxamide
CID 122567299
1-(heptan-2-ylcarbamoyl)piperidine-4-carboxylic acid
CID 61465992

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide (CID 110894480) is 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide is CC(C)CCCC(C)NC(=O)N1CCC(CO)CC1.
What is the InChIKey of 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide?
The InChIKey is LYYHANNTJVTQDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)5-4-6-13(3)16-15(19)17-9-7-14(11-18)8-10-17/h12-14,18H,4-11H2,1-3H3,(H,16,19).
What are the key properties of 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide?
4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide has a molecular weight of 270.42 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-N-(6-methylheptan-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 110894480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).