3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol

C11H26N2O — CID 114356461

IUPAC3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol
SMILESCC(C)N(C)C(CO)C(N)C(C)(C)C
InChIInChI=1S/C11H26N2O/c1-8(2)13(6)9(7-14)10(12)11(3,4)5/h8-10,14H,7,12H2,1-6H3
InChIKeyWOACBOOCRJBFNW-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.06
Rot. Bonds4

About 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol

3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol (PubChem CID 114356461) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol.

Molecular Properties

Compound Name3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol
PubChem CID114356461
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol
SMILESCC(C)N(C)C(CO)C(N)C(C)(C)C
InChIInChI=1S/C11H26N2O/c1-8(2)13(6)9(7-14)10(12)11(3,4)5/h8-10,14H,7,12H2,1-6H3
InChIKeyWOACBOOCRJBFNW-UHFFFAOYSA-N
XLogP1.06
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)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

3-amino-4,4-dimethyl-2-[methyl(2,2,2-trifluoroethyl)amino]pentan-1-ol
CID 114356743
3-amino-2-[cyclopropyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114356557
3-amino-2-[butyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114356500
3-amino-4,4-dimethyl-2-[methyl(pentyl)amino]pentan-1-ol
CID 114356628
3-amino-2-[3-methoxypropyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114357181
3-amino-2-[bis(cyclopropylmethyl)amino]-4,4-dimethylpentan-1-ol
CID 114357352
3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol
CID 105414476
3-amino-2-[cyclopropylmethyl(ethyl)amino]-4,4-dimethylpentan-1-ol
CID 114357327
3-amino-2-[3-(diethylamino)propyl-ethylamino]-4,4-dimethylpentan-1-ol
CID 102992599
(2R)-2-(dimethylamino)-3-methylbutan-1-ol
CID 93492101
3-amino-4,4-dimethyl-2-[methyl(pyridin-2-ylmethyl)amino]pentan-1-ol
CID 114356672
3-amino-4,4-dimethyl-2-(3-methylbutoxy)pentan-1-ol
CID 114358012

Frequently Asked Questions

What is the IUPAC name of 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol?
The IUPAC name of 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol (CID 114356461) is 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol.
What is the SMILES notation for 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol?
The canonical SMILES for 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol is CC(C)N(C)C(CO)C(N)C(C)(C)C.
What is the InChIKey of 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol?
The InChIKey is WOACBOOCRJBFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-8(2)13(6)9(7-14)10(12)11(3,4)5/h8-10,14H,7,12H2,1-6H3.
What are the key properties of 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol?
3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol has a molecular weight of 202.34 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4,4-dimethyl-2-[methyl(propan-2-yl)amino]pentan-1-ol is sourced from PubChem (CID 114356461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).