3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol

C15H24N2O — CID 107185407

IUPAC3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol
SMILESCC1(C)CCCC1C(O)C(CN)c1ccccn1
InChIInChI=1S/C15H24N2O/c1-15(2)8-5-6-12(15)14(18)11(10-16)13-7-3-4-9-17-13/h3-4,7,9,11-12,14,18H,5-6,8,10,16H2,1-2H3
InChIKeyPMGJVBDNOLBNNI-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.31
Rot. Bonds4

About 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol

3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol (PubChem CID 107185407) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol
PubChem CID107185407
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol
SMILESCC1(C)CCCC1C(O)C(CN)c1ccccn1
InChIInChI=1S/C15H24N2O/c1-15(2)8-5-6-12(15)14(18)11(10-16)13-7-3-4-9-17-13/h3-4,7,9,11-12,14,18H,5-6,8,10,16H2,1-2H3
InChIKeyPMGJVBDNOLBNNI-UHFFFAOYSA-N
XLogP2.31
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-(2,2-dimethylcyclohexyl)-2-pyridin-2-ylpropan-1-ol
CID 107185410
3-amino-2-(2-chlorophenyl)-1-(2,2-dimethylcyclohexyl)propan-1-ol
CID 107185223
3-amino-1-(2,2-dimethylcyclopentyl)-2-(4-ethoxyphenyl)propan-1-ol
CID 107185333
4-amino-1-cyclopentyl-3-pyridin-2-ylbutan-2-ol
CID 80527107
1-amino-4-cyclopropyl-2-pyridin-2-ylpentan-3-ol
CID 83150029
3-amino-1-(2,2-dimethylcyclohexyl)-2-(4-methylphenyl)propan-1-ol
CID 107185349
(2R)-3-methyl-2-pyridin-2-ylbutan-1-amine
CID 96736561
3-amino-1-(4-methylthiophen-3-yl)-2-pyridin-2-ylpropan-1-ol
CID 80525924
3-amino-1-(2-methoxyphenyl)-2-pyridin-2-ylpropan-1-ol
CID 80527197
(2,2-dimethylcyclopentyl)-(4-fluoronaphthalen-1-yl)methanol
CID 107181750
2-amino-1-cyclopropyl-2-pyridin-2-ylethanol
CID 82409953
[1-(2,2-dimethylcyclopentyl)-2-quinolin-4-ylethyl]hydrazine
CID 107194203

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol?
The IUPAC name of 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol (CID 107185407) is 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol is CC1(C)CCCC1C(O)C(CN)c1ccccn1.
What is the InChIKey of 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol?
The InChIKey is PMGJVBDNOLBNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-15(2)8-5-6-12(15)14(18)11(10-16)13-7-3-4-9-17-13/h3-4,7,9,11-12,14,18H,5-6,8,10,16H2,1-2H3.
What are the key properties of 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol?
3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2,2-dimethylcyclopentyl)-2-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 107185407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).