6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol

C15H31NO — CID 106802461

IUPAC6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol
SMILESCCC(O)CCCN(CC(C)C)C1CCCC1
InChIInChI=1S/C15H31NO/c1-4-15(17)10-7-11-16(12-13(2)3)14-8-5-6-9-14/h13-15,17H,4-12H2,1-3H3
InChIKeyJYIVBHJTLXWZJQ-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.44
Rot. Bonds8

About 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol

6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol (PubChem CID 106802461) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol.

Molecular Properties

Compound Name6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol
PubChem CID106802461
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol
SMILESCCC(O)CCCN(CC(C)C)C1CCCC1
InChIInChI=1S/C15H31NO/c1-4-15(17)10-7-11-16(12-13(2)3)14-8-5-6-9-14/h13-15,17H,4-12H2,1-3H3
InChIKeyJYIVBHJTLXWZJQ-UHFFFAOYSA-N
XLogP3.44
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[cyclopentyl(2-methylpropyl)amino]hexan-1-ol
CID 103737867
3-[cyclopentyl(3-methylbutyl)amino]propane-1,2-diol
CID 82850075
1-[cyclopentyl(ethyl)amino]butan-2-ol
CID 60886562
1-cyclopentyl-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol
CID 103159907
N-(5-methylhexyl)-N-propylcyclohexanamine
CID 167070487
6-[bis(3-methylbutyl)amino]hexan-3-ol
CID 107870897
6-[cyclopropyl(2-methylpropyl)amino]hexan-1-ol
CID 103737780
3-[cyclopentyl(2-methylpropyl)amino]propanamide
CID 78983793
N-[3-(4-methylpentoxy)propyl]-N-(2-methylpropyl)cyclopropanamine
CID 138728540
N-butyl-N-[2-(3-methylbutoxy)ethyl]cyclohexanamine
CID 170541781
1-[cyclopentyl(2-methylpropyl)amino]-3-propan-2-yloxypropan-2-ol
CID 78983735
2-[cyclopentyl(2-methylpentyl)amino]ethanol
CID 62266267

Frequently Asked Questions

What is the IUPAC name of 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol?
The IUPAC name of 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol (CID 106802461) is 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol.
What is the SMILES notation for 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol?
The canonical SMILES for 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol is CCC(O)CCCN(CC(C)C)C1CCCC1.
What is the InChIKey of 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol?
The InChIKey is JYIVBHJTLXWZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-4-15(17)10-7-11-16(12-13(2)3)14-8-5-6-9-14/h13-15,17H,4-12H2,1-3H3.
What are the key properties of 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol?
6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol has a molecular weight of 241.42 g/mol, XLogP of 3.44, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[cyclopentyl(2-methylpropyl)amino]hexan-3-ol is sourced from PubChem (CID 106802461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).