3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol

C11H26N2O — CID 104840311

IUPAC3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol
SMILESCCCN(C(C)C)C(CO)C(N)CC
InChIInChI=1S/C11H26N2O/c1-5-7-13(9(3)4)11(8-14)10(12)6-2/h9-11,14H,5-8,12H2,1-4H3
InChIKeyNVUOLGNSZNERRB-UHFFFAOYSA-N
MW202.34 g/mol
LogP1.21
Rot. Bonds7

About 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol

3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol (PubChem CID 104840311) has the molecular formula C11H26N2O and a molecular weight of 202.34 g/mol. Its IUPAC name is 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol.

Molecular Properties

Compound Name3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol
PubChem CID104840311
Molecular FormulaC11H26N2O
Molecular Weight202.34 g/mol
Exact Mass202.20
IUPAC Name3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol
SMILESCCCN(C(C)C)C(CO)C(N)CC
InChIInChI=1S/C11H26N2O/c1-5-7-13(9(3)4)11(8-14)10(12)6-2/h9-11,14H,5-8,12H2,1-4H3
InChIKeyNVUOLGNSZNERRB-UHFFFAOYSA-N
XLogP1.21
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-2-[propan-2-yl(propyl)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-methoxy-2-[propan-2-yl(propyl)amino]butan-1-ol
CID 114356584
3-N-propan-2-yl-3-N-propylheptane-3,4-diamine
CID 43269503
3-amino-4-methoxy-2-[pentyl(propan-2-yl)amino]butan-1-ol
CID 114356963
3-amino-2-[propan-2-yl(propyl)amino]propan-1-ol
CID 104710820
3-amino-2-[2-methoxyethyl(pentan-3-yl)amino]pentan-1-ol
CID 104840396
3-amino-2-[ethyl(2-methylpropyl)amino]pentan-1-ol
CID 104840317
N'-hydroxy-3-[propan-2-yl(propyl)amino]pentanimidamide
CID 43269637
N'-hydroxy-2-[propan-2-yl(propyl)amino]butanimidamide
CID 76915771
3-amino-3-cyclopropyl-2-(dipropylamino)propan-1-ol
CID 114356470
2-[2-[butan-2-yl(propan-2-yl)amino]ethyl-(1-hydroxypropan-2-yl)amino]propan-1-ol
CID 22971826
3-amino-2-[ethyl(2,2,2-trifluoroethyl)amino]pentan-1-ol
CID 104840399
3-amino-2-[propan-2-yl(propyl)amino]propanoic acid
CID 64695014

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol?
The IUPAC name of 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol (CID 104840311) is 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol.
What is the SMILES notation for 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol?
The canonical SMILES for 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol is CCCN(C(C)C)C(CO)C(N)CC.
What is the InChIKey of 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol?
The InChIKey is NVUOLGNSZNERRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O/c1-5-7-13(9(3)4)11(8-14)10(12)6-2/h9-11,14H,5-8,12H2,1-4H3.
What are the key properties of 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol?
3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol has a molecular weight of 202.34 g/mol, XLogP of 1.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-[propan-2-yl(propyl)amino]pentan-1-ol is sourced from PubChem (CID 104840311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).