1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol

C14H27NO — CID 79128862

IUPAC1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol
SMILESCC1CCC(CN)(C2(O)CCCCCC2)C1
InChIInChI=1S/C14H27NO/c1-12-6-9-13(10-12,11-15)14(16)7-4-2-3-5-8-14/h12,16H,2-11,15H2,1H3
InChIKeyLEMVXQIHPJQKOA-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.84
Rot. Bonds2

About 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol

1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol (PubChem CID 79128862) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol.

Molecular Properties

Compound Name1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol
PubChem CID79128862
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol
SMILESCC1CCC(CN)(C2(O)CCCCCC2)C1
InChIInChI=1S/C14H27NO/c1-12-6-9-13(10-12,11-15)14(16)7-4-2-3-5-8-14/h12,16H,2-11,15H2,1H3
InChIKeyLEMVXQIHPJQKOA-UHFFFAOYSA-N
XLogP2.84
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-(aminomethyl)-3-methylcyclopentyl]-1-methylpiperidin-4-ol
CID 79135647
3-[1-(aminomethyl)-3-methylcyclopentyl]pyrrolidin-3-ol
CID 79134673
1-[1-(aminomethyl)cyclobutyl]-3-methylcyclopentan-1-ol
CID 79124196
1-[1-(aminomethyl)-3-methylcyclopentyl]-4-(trifluoromethyl)cyclohexan-1-ol
CID 79126439
1-[1-(aminomethyl)-3-methylcyclohexyl]-4-tert-butylcycloheptan-1-ol
CID 79125209
4-[1-(aminomethyl)-3-methylcyclopentyl]-1-propylazepan-4-ol
CID 79124838
1-[1-(aminomethyl)cycloheptyl]cyclohexan-1-ol
CID 79128633
1-[1-(aminomethyl)-4,4-dimethylcyclohexyl]cycloheptan-1-ol
CID 79127542
4-[1-(aminomethyl)-3-methylcyclopentyl]-1-propylpiperidin-4-ol
CID 79135208
1-[1-(aminomethyl)-3-ethylcyclopentyl]-4-methylcycloheptan-1-ol
CID 79124842
1-[1-(aminomethyl)-3-ethylcyclohexyl]cyclohexan-1-ol
CID 79127098
1-[1-(aminomethyl)-4-methylcyclohexyl]-3-propan-2-ylcyclohexan-1-ol
CID 107450677

Frequently Asked Questions

What is the IUPAC name of 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol?
The IUPAC name of 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol (CID 79128862) is 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol.
What is the SMILES notation for 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol?
The canonical SMILES for 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol is CC1CCC(CN)(C2(O)CCCCCC2)C1.
What is the InChIKey of 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol?
The InChIKey is LEMVXQIHPJQKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12-6-9-13(10-12,11-15)14(16)7-4-2-3-5-8-14/h12,16H,2-11,15H2,1H3.
What are the key properties of 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol?
1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol is sourced from PubChem (CID 79128862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).