2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol

C16H34N2O — CID 106809226

IUPAC2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol
SMILESCCCCCN(C)CCCC(CC)(CO)NC1CC1
InChIInChI=1S/C16H34N2O/c1-4-6-7-12-18(3)13-8-11-16(5-2,14-19)17-15-9-10-15/h15,17,19H,4-14H2,1-3H3
InChIKeyAZJXIZYIXYIXLN-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.78
Rot. Bonds12

About 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol

2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol (PubChem CID 106809226) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol
PubChem CID106809226
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol
SMILESCCCCCN(C)CCCC(CC)(CO)NC1CC1
InChIInChI=1S/C16H34N2O/c1-4-6-7-12-18(3)13-8-11-16(5-2,14-19)17-15-9-10-15/h15,17,19H,4-14H2,1-3H3
InChIKeyAZJXIZYIXYIXLN-UHFFFAOYSA-N
XLogP2.78
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]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

5-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)-2-ethylpentan-1-ol
CID 106809250
5-[cyclopentylmethyl(methyl)amino]-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808716
2-(cyclopropylamino)-2-ethyl-5-octan-2-yloxypentan-1-ol
CID 106810269
2-(cyclopropylamino)-2-ethyl-5-[2-(2-methoxyethoxy)ethoxy]pentan-1-ol
CID 106810706
2-(cyclopropylamino)-2-methyl-5-[pentyl(propan-2-yl)amino]pentan-1-ol
CID 64827354
2-ethyl-5-[3-methoxypropyl(methyl)amino]-2-(propylamino)pentan-1-ol
CID 106808842
2-(cyclopropylamino)-2-ethyl-5-(4-propylpiperidin-1-yl)pentan-1-ol
CID 106808663
2-(cyclopentylamino)-2-ethylpropane-1,3-diol
CID 115924300
2-ethyl-2-(methylamino)-5-[methyl-[(2-methylcyclopropyl)methyl]amino]pentan-1-ol
CID 106808784
2-(cyclopropylamino)-5-(2,2-difluoroethoxy)-2-ethylpentan-1-ol
CID 106810677
N-cyclopropyl-N'-methyl-N'-pentylbutane-1,4-diamine
CID 62420379
2-(cyclopropylamino)-2-ethyl-5-(2-propylpiperidin-1-yl)pentan-1-ol
CID 106809824

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol (CID 106809226) is 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol is CCCCCN(C)CCCC(CC)(CO)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol?
The InChIKey is AZJXIZYIXYIXLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-6-7-12-18(3)13-8-11-16(5-2,14-19)17-15-9-10-15/h15,17,19H,4-14H2,1-3H3.
What are the key properties of 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol?
2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol has a molecular weight of 270.46 g/mol, XLogP of 2.78, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-2-ethyl-5-[methyl(pentyl)amino]pentan-1-ol is sourced from PubChem (CID 106809226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).