1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol

C14H29NO — CID 115718135

IUPAC1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol
SMILESCCCCC1CCCC1NCC(C)(O)CC
InChIInChI=1S/C14H29NO/c1-4-6-8-12-9-7-10-13(12)15-11-14(3,16)5-2/h12-13,15-16H,4-11H2,1-3H3
InChIKeyMFKVXCPCLMCTFV-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.10
Rot. Bonds7

About 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol

1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol (PubChem CID 115718135) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol
PubChem CID115718135
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol
SMILESCCCCC1CCCC1NCC(C)(O)CC
InChIInChI=1S/C14H29NO/c1-4-6-8-12-9-7-10-13(12)15-11-14(3,16)5-2/h12-13,15-16H,4-11H2,1-3H3
InChIKeyMFKVXCPCLMCTFV-UHFFFAOYSA-N
XLogP3.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylbutan-2-ol
CID 106361004
2-methyl-1-[(2-methylcycloheptyl)amino]butan-2-ol
CID 114493275
N-ethyl-2-octylcyclopentan-1-amine
CID 63399748
3-[[(2-ethylcyclopentyl)amino]methyl]pentan-3-ol
CID 115714750
(2-butylcyclopentyl)carbamic acid
CID 142463044
3-[[[2-(hydroxymethyl)cyclopentyl]amino]methyl]pentan-3-ol
CID 106360920
3-[(2-hexylcyclopentyl)amino]propan-1-ol
CID 115705219
N,N'-bis(2-hexylcyclohexyl)methanediamine
CID 175881846
1-[[2-(aminomethyl)cyclopentyl]amino]-2-methyl-3-methylsulfanylpropan-2-ol
CID 106246114
2-butyl-N-methylcyclohexan-1-amine;propan-1-ol
CID 71071796
trans-(1R,2S)-N-ethyl-2-propylcyclopentan-1-amine
CID 11665449
2-[(1S,2S)-2-(3,3-dimethylbutylamino)cyclopentyl]ethanol
CID 99826080

Frequently Asked Questions

What is the IUPAC name of 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol?
The IUPAC name of 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol (CID 115718135) is 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol.
What is the SMILES notation for 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol?
The canonical SMILES for 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol is CCCCC1CCCC1NCC(C)(O)CC.
What is the InChIKey of 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol?
The InChIKey is MFKVXCPCLMCTFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-4-6-8-12-9-7-10-13(12)15-11-14(3,16)5-2/h12-13,15-16H,4-11H2,1-3H3.
What are the key properties of 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol?
1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol has a molecular weight of 227.39 g/mol, XLogP of 3.10, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-butylcyclopentyl)amino]-2-methylbutan-2-ol is sourced from PubChem (CID 115718135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).