[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol

C13H28N2O — CID 79656766

IUPAC[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCC(N(C)C(C)C)C1
InChIInChI=1S/C13H28N2O/c1-10(2)14-13(9-16)7-6-12(8-13)15(5)11(3)4/h10-12,14,16H,6-9H2,1-5H3
InChIKeyPXRSLJXHPXNFDN-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.61
Rot. Bonds5

About [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol

[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol (PubChem CID 79656766) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
PubChem CID79656766
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
SMILESCC(C)NC1(CO)CCC(N(C)C(C)C)C1
InChIInChI=1S/C13H28N2O/c1-10(2)14-13(9-16)7-6-12(8-13)15(5)11(3)4/h10-12,14,16H,6-9H2,1-5H3
InChIKeyPXRSLJXHPXNFDN-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(methylamino)-3-[methyl(propan-2-yl)amino]cyclopentyl]methanol
CID 79656680
[3-[methyl(2-methylbutyl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656362
[3-[cyclopentylmethyl(methyl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656417
[3-[2-methylpropyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656468
[3-[pentyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656708
[3-[methyl(oxan-4-ylmethyl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656830
[3-[ethyl(methyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635385
[3-[cyclopropylmethyl(propyl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656704
[3-[2-(dimethylamino)ethyl-methylamino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79635513
[3-[methyl(3-methylbutyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79640094
[3-[methyl-(2-methylcyclohexyl)amino]-1-(propan-2-ylamino)cyclohexyl]methanol
CID 79634733
[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
CID 79656781

Frequently Asked Questions

What is the IUPAC name of [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol?
The IUPAC name of [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol (CID 79656766) is [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol.
What is the SMILES notation for [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol?
The canonical SMILES for [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol is CC(C)NC1(CO)CCC(N(C)C(C)C)C1.
What is the InChIKey of [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol?
The InChIKey is PXRSLJXHPXNFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-10(2)14-13(9-16)7-6-12(8-13)15(5)11(3)4/h10-12,14,16H,6-9H2,1-5H3.
What are the key properties of [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol?
[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol has a molecular weight of 228.38 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol is sourced from PubChem (CID 79656766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).