1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol

C15H29NO — CID 107418138

IUPAC1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol
SMILESCC1CCCC1CNCC(O)CC1CCCC1
InChIInChI=1S/C15H29NO/c1-12-5-4-8-14(12)10-16-11-15(17)9-13-6-2-3-7-13/h12-17H,2-11H2,1H3
InChIKeyIMUDBJOMJPZEBN-UHFFFAOYSA-N
MW239.40 g/mol
LogP2.95
Rot. Bonds6

About 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol

1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol (PubChem CID 107418138) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol
PubChem CID107418138
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol
SMILESCC1CCCC1CNCC(O)CC1CCCC1
InChIInChI=1S/C15H29NO/c1-12-5-4-8-14(12)10-16-11-15(17)9-13-6-2-3-7-13/h12-17H,2-11H2,1H3
InChIKeyIMUDBJOMJPZEBN-UHFFFAOYSA-N
XLogP2.95
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylcyclohexyl)methylamino]propane-1,2-diol
CID 76912799
3-[[(3-cyclopentyl-2-hydroxypropyl)amino]methyl]cyclobutan-1-ol
CID 103157965
1-(2-butoxyethoxy)-3-[(2-methylcyclopentyl)methylamino]propan-2-ol
CID 107417945
(3R)-3-methyl-4-[[(1S,2R)-2-methylcyclohexyl]methylamino]butan-1-ol
CID 124743507
2-[(3-cyclopentyl-2-hydroxypropyl)amino]-N-methylacetamide
CID 103157245
1-cyclopentyl-3-(2,3,3-trimethylbutylamino)propan-2-ol
CID 103158223
1-cyclopentyl-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 103158287
1-[[(3-cyclopentyl-2-hydroxypropyl)amino]methyl]-3-methylcyclohexan-1-ol
CID 103157916
1-cyclopentyl-3-(3-hydroxypropylamino)propan-2-ol
CID 103157277
1-cyclopentyl-3-(2,2,2-trifluoroethylamino)propan-2-ol
CID 103157182
N-[(2-methylcyclohexyl)methyl]-1-piperidin-4-ylmethanamine
CID 79708112
1-cyclopropyl-N-[(2-methylcyclohexyl)methyl]propan-2-amine
CID 115713187

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol (CID 107418138) is 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol is CC1CCCC1CNCC(O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol?
The InChIKey is IMUDBJOMJPZEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-12-5-4-8-14(12)10-16-11-15(17)9-13-6-2-3-7-13/h12-17H,2-11H2,1H3.
What are the key properties of 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol?
1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol has a molecular weight of 239.40 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[(2-methylcyclopentyl)methylamino]propan-2-ol is sourced from PubChem (CID 107418138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).