[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol

C13H28N2O — CID 79656781

IUPAC[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
SMILESCCCC(C)N(C)C1CCC(CO)(NC)C1
InChIInChI=1S/C13H28N2O/c1-5-6-11(2)15(4)12-7-8-13(9-12,10-16)14-3/h11-12,14,16H,5-10H2,1-4H3
InChIKeyHMOMWWWCSCEFCP-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.61
Rot. Bonds6

About [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol

[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol (PubChem CID 79656781) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
PubChem CID79656781
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol
SMILESCCCC(C)N(C)C1CCC(CO)(NC)C1
InChIInChI=1S/C13H28N2O/c1-5-6-11(2)15(4)12-7-8-13(9-12,10-16)14-3/h11-12,14,16H,5-10H2,1-4H3
InChIKeyHMOMWWWCSCEFCP-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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
[1-(ethylamino)-3-[methyl(pentan-2-yl)amino]cyclohexyl]methanol
CID 79640702
[3-[methyl(4-methylpentan-2-yl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79656145
[3-[3,3-dimethylbutan-2-yl(methyl)amino]-1-(methylamino)cyclohexyl]methanol
CID 79640947
[3-[1-methoxypropan-2-yl(methyl)amino]-1-(propylamino)cyclopentyl]methanol
CID 79655810
[3-[methyl(propan-2-yl)amino]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656766
[1-(cyclopropylamino)-3-[1-methoxypropan-2-yl(methyl)amino]cyclopentyl]methanol
CID 79655891
3-[methyl(pentan-2-yl)amino]-1-(propan-2-ylamino)cyclopentane-1-carbonitrile
CID 79638696
[1-(methylamino)-3-(3-methylbutan-2-ylsulfanyl)cyclopentyl]methanol
CID 107764767
[3-[ethyl(2,2,2-trifluoroethyl)amino]-1-(methylamino)cyclopentyl]methanol
CID 79656870
1-N,4-N-dimethyl-4-N-pentan-2-ylcyclohexane-1,4-diamine
CID 79111269
[1-(methylamino)-3-propan-2-ylsulfanylcyclopentyl]methanol
CID 79645826

Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol (CID 79656781) is [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol is CCCC(C)N(C)C1CCC(CO)(NC)C1.
What is the InChIKey of [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol?
The InChIKey is HMOMWWWCSCEFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-5-6-11(2)15(4)12-7-8-13(9-12,10-16)14-3/h11-12,14,16H,5-10H2,1-4H3.
What are the key properties of [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol?
[1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol has a molecular weight of 228.38 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-[methyl(pentan-2-yl)amino]cyclopentyl]methanol is sourced from PubChem (CID 79656781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).