3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol

C14H32N2O — CID 64827631

IUPAC3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCCCN(CC(C)(CO)NCC)C(C)CC
InChIInChI=1S/C14H32N2O/c1-6-9-10-16(13(4)7-2)11-14(5,12-17)15-8-3/h13,15,17H,6-12H2,1-5H3
InChIKeyZLEZXGGORLPPQZ-UHFFFAOYSA-N
MW244.42 g/mol
LogP2.25
Rot. Bonds10

About 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol

3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol (PubChem CID 64827631) has the molecular formula C14H32N2O and a molecular weight of 244.42 g/mol. Its IUPAC name is 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
PubChem CID64827631
Molecular FormulaC14H32N2O
Molecular Weight244.42 g/mol
Exact Mass244.25
IUPAC Name3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCCCN(CC(C)(CO)NCC)C(C)CC
InChIInChI=1S/C14H32N2O/c1-6-9-10-16(13(4)7-2)11-14(5,12-17)15-8-3/h13,15,17H,6-12H2,1-5H3
InChIKeyZLEZXGGORLPPQZ-UHFFFAOYSA-N
XLogP2.25
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.42
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-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

6-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylhexan-1-ol
CID 64827639
2-methyl-3-[pentyl(propan-2-yl)amino]-2-(propylamino)propan-1-ol
CID 64826760
1-N-butan-2-yl-1-N-butyl-2,2-dimethylbutane-1,3-diamine
CID 66453228
2-(ethylamino)-2-methyl-3-[methyl(3-methylbutyl)amino]propan-1-ol
CID 64826613
2-(ethylamino)-2-methyl-5-[2-methylpropyl(propan-2-yl)amino]pentan-1-ol
CID 64828003
3-[3,3-dimethylbutan-2-yl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
CID 64826895
4-[butyl(ethyl)amino]-2-methyl-2-(propan-2-ylamino)pentan-1-ol
CID 64798809
3-[ethyl(propan-2-yl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64795479
2-(ethylamino)-4-[ethyl(propan-2-yl)amino]-2-methylbutan-1-ol
CID 64797860
2-(ethylamino)-6-[2-methoxyethyl(propan-2-yl)amino]-2-methylhexan-1-ol
CID 82965249
2-(ethylamino)-2-methyl-4-[methyl(pentyl)amino]butan-1-ol
CID 64796168
N-butan-2-yl-N-butyl-2-methyl-N',2-dipropylpropane-1,3-diamine
CID 63493237

Frequently Asked Questions

What is the IUPAC name of 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The IUPAC name of 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol (CID 64827631) is 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol.
What is the SMILES notation for 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The canonical SMILES for 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol is CCCCN(CC(C)(CO)NCC)C(C)CC.
What is the InChIKey of 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The InChIKey is ZLEZXGGORLPPQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O/c1-6-9-10-16(13(4)7-2)11-14(5,12-17)15-8-3/h13,15,17H,6-12H2,1-5H3.
What are the key properties of 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol has a molecular weight of 244.42 g/mol, XLogP of 2.25, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[butan-2-yl(butyl)amino]-2-(ethylamino)-2-methylpropan-1-ol is sourced from PubChem (CID 64827631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).