3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol

C15H33N3O — CID 105414476

IUPAC3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol
SMILESCN(CC1(N(C)C)CCC1)C(CO)C(N)C(C)(C)C
InChIInChI=1S/C15H33N3O/c1-14(2,3)13(16)12(10-19)18(6)11-15(17(4)5)8-7-9-15/h12-13,19H,7-11,16H2,1-6H3
InChIKeyNZEYTTIZWBXVPE-UHFFFAOYSA-N
MW271.45 g/mol
LogP1.14
Rot. Bonds6

About 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol

3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol (PubChem CID 105414476) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol.

Molecular Properties

Compound Name3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol
PubChem CID105414476
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol
SMILESCN(CC1(N(C)C)CCC1)C(CO)C(N)C(C)(C)C
InChIInChI=1S/C15H33N3O/c1-14(2,3)13(16)12(10-19)18(6)11-15(17(4)5)8-7-9-15/h12-13,19H,7-11,16H2,1-6H3
InChIKeyNZEYTTIZWBXVPE-UHFFFAOYSA-N
XLogP1.14
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol with MolForge

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Related Compounds

1-N-tert-butyl-2-N-[[1-(dimethylamino)cyclobutyl]methyl]-2-N,3-dimethylbutane-1,2-diamine
CID 105417765
N,N-dimethyl-1-[[methyl(propan-2-yl)amino]methyl]cyclobutan-1-amine
CID 176568551
3-amino-2-[butyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114356500
2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]propanamide
CID 105416404
1-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-3,3-dimethylbutan-2-ol
CID 105416425
3-amino-4,4-dimethyl-2-[methyl(pentyl)amino]pentan-1-ol
CID 114356628
2-amino-4-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-2-methylpentanoic acid
CID 105416899
3-amino-2-[cyclopropyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114356557
3-N-[[1-(dimethylamino)cyclobutyl]methyl]-3-N,4-N-dimethylheptane-3,4-diamine
CID 105414348
3-amino-2-[3-methoxypropyl(methyl)amino]-4,4-dimethylpentan-1-ol
CID 114357181
4-amino-N-tert-butyl-3-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]butanamide
CID 105414000
(2R)-2-amino-N-[[1-(dimethylamino)cyclobutyl]methyl]-N,3-dimethylbutanamide
CID 105417719

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol?
The IUPAC name of 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol (CID 105414476) is 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol.
What is the SMILES notation for 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol?
The canonical SMILES for 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol is CN(CC1(N(C)C)CCC1)C(CO)C(N)C(C)(C)C.
What is the InChIKey of 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol?
The InChIKey is NZEYTTIZWBXVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-14(2,3)13(16)12(10-19)18(6)11-15(17(4)5)8-7-9-15/h12-13,19H,7-11,16H2,1-6H3.
What are the key properties of 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol?
3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol has a molecular weight of 271.45 g/mol, XLogP of 1.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]-4,4-dimethylpentan-1-ol is sourced from PubChem (CID 105414476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).