[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol

C14H29NO — CID 115724050

IUPAC[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol
SMILESCCCCC(CC)NC1CCCC1(C)CO
InChIInChI=1S/C14H29NO/c1-4-6-8-12(5-2)15-13-9-7-10-14(13,3)11-16/h12-13,15-16H,4-11H2,1-3H3
InChIKeyAZLMWNSWYUGWDS-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.10
Rot. Bonds7

About [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol

[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol (PubChem CID 115724050) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol.

Molecular Properties

Compound Name[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol
PubChem CID115724050
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol
SMILESCCCCC(CC)NC1CCCC1(C)CO
InChIInChI=1S/C14H29NO/c1-4-6-8-12(5-2)15-13-9-7-10-14(13,3)11-16/h12-13,15-16H,4-11H2,1-3H3
InChIKeyAZLMWNSWYUGWDS-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(hexan-3-ylamino)-1-methylcyclopentyl]methanol
CID 115905963
[2-(hept-6-en-3-ylamino)-1-methylcyclopentyl]methanol
CID 115724046
3-[(2,2-dimethylcyclopentyl)amino]pentan-1-ol
CID 115723124
2-[(2,2-dimethylcyclopentyl)amino]hexanoic acid
CID 103256663
N-hexan-3-ylspiro[3.5]nonan-3-amine
CID 102951793
[2-(2,2-dimethylpropylamino)-1-methylcyclopentyl]methanol
CID 115655345
N-heptan-3-yl-2,2,6,6-tetramethylpiperidin-4-amine
CID 63944315
4-ethyl-1-[(heptan-3-ylamino)methyl]cyclohexan-1-ol
CID 65115837
3-(heptan-3-ylamino)-1-piperidin-1-ylpropan-1-one
CID 112700170
1-(2,2-dimethylcyclopentyl)-3-[2-(hydroxymethyl)-2-methylcyclopentyl]urea
CID 111841148
[1-methyl-2-[1-(1,3-thiazol-4-yl)ethylamino]cyclopentyl]methanol
CID 115879388
2-[(2,2-dimethylcyclopentyl)amino]-N-pentan-3-ylpropanamide
CID 79861523

Frequently Asked Questions

What is the IUPAC name of [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol?
The IUPAC name of [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol (CID 115724050) is [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol.
What is the SMILES notation for [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol?
The canonical SMILES for [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol is CCCCC(CC)NC1CCCC1(C)CO.
What is the InChIKey of [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol?
The InChIKey is AZLMWNSWYUGWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-4-6-8-12(5-2)15-13-9-7-10-14(13,3)11-16/h12-13,15-16H,4-11H2,1-3H3.
What are the key properties of [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol?
[2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol has a molecular weight of 227.39 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(heptan-3-ylamino)-1-methylcyclopentyl]methanol is sourced from PubChem (CID 115724050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).