5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol

C14H29NO2 — CID 79856473

IUPAC5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
SMILESCCC(C)N(CCOC)C1CCC(C)(C)C1O
InChIInChI=1S/C14H29NO2/c1-6-11(2)15(9-10-17-5)12-7-8-14(3,4)13(12)16/h11-13,16H,6-10H2,1-5H3
InChIKeyNDCVSHTUVSUEAM-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.28
Rot. Bonds6

About 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol

5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol (PubChem CID 79856473) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
PubChem CID79856473
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
SMILESCCC(C)N(CCOC)C1CCC(C)(C)C1O
InChIInChI=1S/C14H29NO2/c1-6-11(2)15(9-10-17-5)12-7-8-14(3,4)13(12)16/h11-13,16H,6-10H2,1-5H3
InChIKeyNDCVSHTUVSUEAM-UHFFFAOYSA-N
XLogP2.28
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[cyclopropyl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol
CID 79857606
5-[ethyl(propan-2-yl)amino]-2,2-dimethylcyclopentan-1-ol
CID 79856812
5-[[2-methoxyethyl(pentan-3-yl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855744
1-N-(2-methoxyethyl)-2-N,3,3-trimethyl-1-N-pentan-3-ylcyclopentane-1,2-diamine
CID 79859981
2-[butan-2-yl(2-methoxyethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420046
2-[butan-2-yl(2-methoxyethyl)amino]cyclohexane-1-carbonitrile
CID 55000052
1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-N,3,3-trimethylcyclohexane-1,2-diamine
CID 79828530
2-[2-methoxyethyl(propan-2-yl)amino]cyclopentan-1-ol
CID 82960183
1-N-(2-methoxyethyl)-2-N,3,3-trimethyl-1-N-pentan-3-ylcyclohexane-1,2-diamine
CID 79829504
methyl 3-[butan-2-yl(2-methoxyethyl)amino]-1-(methylamino)cyclohexane-1-carboxylate
CID 79627687
2-(aminomethyl)-N-butan-2-yl-5-ethyl-N-(2-methoxyethyl)cyclohexan-1-amine
CID 55001186
2-[butan-2-yl(2-methoxyethyl)amino]-4-methylcyclohexane-1-carbonitrile
CID 55000005

Frequently Asked Questions

What is the IUPAC name of 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol (CID 79856473) is 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol is CCC(C)N(CCOC)C1CCC(C)(C)C1O.
What is the InChIKey of 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol?
The InChIKey is NDCVSHTUVSUEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-6-11(2)15(9-10-17-5)12-7-8-14(3,4)13(12)16/h11-13,16H,6-10H2,1-5H3.
What are the key properties of 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol?
5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol has a molecular weight of 243.39 g/mol, XLogP of 2.28, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 79856473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).