3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol

C12H24N2O — CID 64787425

IUPAC3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
SMILESCN(CC1CCC1)CC(CO)NC1CC1
InChIInChI=1S/C12H24N2O/c1-14(7-10-3-2-4-10)8-12(9-15)13-11-5-6-11/h10-13,15H,2-9H2,1H3
InChIKeyKYLFZPZBBVVYDI-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.83
Rot. Bonds7

About 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol

3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol (PubChem CID 64787425) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol.

Molecular Properties

Compound Name3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
PubChem CID64787425
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
SMILESCN(CC1CCC1)CC(CO)NC1CC1
InChIInChI=1S/C12H24N2O/c1-14(7-10-3-2-4-10)8-12(9-15)13-11-5-6-11/h10-13,15H,2-9H2,1H3
InChIKeyKYLFZPZBBVVYDI-UHFFFAOYSA-N
XLogP0.83
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[cyclohexylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64827404
3-[cyclobutylmethyl(methyl)amino]-2-(propan-2-ylamino)propan-1-ol
CID 64787053
3-[butyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64791382
2-amino-3-[cyclobutylmethyl(methyl)amino]propan-1-ol
CID 64787802
N'-(cyclobutylmethyl)-1-cyclopentyl-N,N'-dimethylethane-1,2-diamine
CID 104745978
2-(cyclopropylamino)-3-(dicyclohexylamino)propan-1-ol
CID 64790779
3-[cyclopentyl(ethyl)amino]-2-(cyclopropylamino)propan-1-ol
CID 64797687
2-(cyclopropylamino)-3-[methyl(2-propan-2-yloxyethyl)amino]propan-1-ol
CID 81062944
3-[cyclohexylmethyl(methyl)amino]propane-1,2-diol
CID 82851087
N'-(cyclohexylmethyl)-1-cyclopentyl-N,N'-dimethylethane-1,2-diamine
CID 113448127
1-cyclohexyl-N'-(cyclohexylmethyl)-N,N'-dimethylethane-1,2-diamine
CID 104745310
2-(ethylamino)-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]propan-1-ol
CID 64792457

Frequently Asked Questions

What is the IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol?
The IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol (CID 64787425) is 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol.
What is the SMILES notation for 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol?
The canonical SMILES for 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol is CN(CC1CCC1)CC(CO)NC1CC1.
What is the InChIKey of 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol?
The InChIKey is KYLFZPZBBVVYDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-14(7-10-3-2-4-10)8-12(9-15)13-11-5-6-11/h10-13,15H,2-9H2,1H3.
What are the key properties of 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol?
3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol has a molecular weight of 212.34 g/mol, XLogP of 0.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)propan-1-ol is sourced from PubChem (CID 64787425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).