4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol

C17H36N2O — CID 64798610

IUPAC4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
SMILESCCN(C(C)CC(C)(CO)NC(C)C)C1CCCCC1
InChIInChI=1S/C17H36N2O/c1-6-19(16-10-8-7-9-11-16)15(4)12-17(5,13-20)18-14(2)3/h14-16,18,20H,6-13H2,1-5H3
InChIKeyNDIRUTIIOXOKTE-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.17
Rot. Bonds8

About 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol

4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol (PubChem CID 64798610) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol.

Molecular Properties

Compound Name4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
PubChem CID64798610
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
SMILESCCN(C(C)CC(C)(CO)NC(C)C)C1CCCCC1
InChIInChI=1S/C17H36N2O/c1-6-19(16-10-8-7-9-11-16)15(4)12-17(5,13-20)18-14(2)3/h14-16,18,20H,6-13H2,1-5H3
InChIKeyNDIRUTIIOXOKTE-UHFFFAOYSA-N
XLogP3.17
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-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

2-amino-4-[cyclohexyl(ethyl)amino]-2-methylpentanamide
CID 64725354
methyl 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(methylamino)pentanoate
CID 64728349
3-[cyclopropyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)propan-1-ol
CID 64798308
4-[ethyl(propyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64798523
2-N-cyclohexyl-2-N-ethylpropane-1,2-diamine
CID 16784373
3-[cyclopentyl(ethyl)amino]-2-methyl-2-(methylamino)propan-1-ol
CID 64797688
2-methyl-4-(2-methylazepan-1-yl)-2-(propan-2-ylamino)pentan-1-ol
CID 64791235
4-[cyclohexyl(ethyl)amino]-2-(cyclopropylamino)-2-methylbutan-1-ol
CID 64798397
5-[cyclopropyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64795940
4-[butyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64798809
N-ethyl-N-propan-2-ylcyclohexanamine;iodomethane
CID 143070375
2-N-cyclopentyl-1-N,2-N-diethylpropane-1,2-diamine
CID 62421955

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The IUPAC name of 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol (CID 64798610) is 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol.
What is the SMILES notation for 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The canonical SMILES for 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol is CCN(C(C)CC(C)(CO)NC(C)C)C1CCCCC1.
What is the InChIKey of 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
The InChIKey is NDIRUTIIOXOKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-6-19(16-10-8-7-9-11-16)15(4)12-17(5,13-20)18-14(2)3/h14-16,18,20H,6-13H2,1-5H3.
What are the key properties of 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol?
4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol has a molecular weight of 284.49 g/mol, XLogP of 3.17, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol is sourced from PubChem (CID 64798610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).