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

C10H22N2O — CID 62860043

IUPAC1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol
SMILESCNCC(O)CN(C)CC1CCC1
InChIInChI=1S/C10H22N2O/c1-11-6-10(13)8-12(2)7-9-4-3-5-9/h9-11,13H,3-8H2,1-2H3
InChIKeyIVAGVMDIKZALSM-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.30
Rot. Bonds6

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

1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol (PubChem CID 62860043) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Name1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol
PubChem CID62860043
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol
SMILESCNCC(O)CN(C)CC1CCC1
InChIInChI=1S/C10H22N2O/c1-11-6-10(13)8-12(2)7-9-4-3-5-9/h9-11,13H,3-8H2,1-2H3
InChIKeyIVAGVMDIKZALSM-UHFFFAOYSA-N
XLogP0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[cyclopropylmethyl(methyl)amino]-3-(propan-2-ylamino)propan-2-ol
CID 60983945
1-[cyclopentylmethyl(methyl)amino]butan-2-ol
CID 63631897
1-[cyclohexylmethyl(methyl)amino]butan-2-ol
CID 61446730
3-[cyclohexylmethyl(methyl)amino]propane-1,2-diol
CID 82851087
1-[cyclopentylmethyl(methyl)amino]-3-(2-methoxyethylamino)propan-2-ol
CID 113317593
1-chloro-3-[cyclohexylmethyl(methyl)amino]propan-2-ol
CID 112561400
2-[cyclohexylmethyl(methyl)amino]-1-cyclopropylethanol
CID 63906781
N'-(cyclobutylmethyl)-1-cyclopentyl-N,N'-dimethylethane-1,2-diamine
CID 104745978
1-[cyclobutylmethyl(methyl)amino]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 111116685
1-(cyclopropylamino)-3-[methyl(oxan-4-ylmethyl)amino]propan-2-ol
CID 63726987
1-[cyclobutylmethyl(methyl)amino]-3-piperazin-1-ylpropan-2-ol
CID 65448880
1-(dimethylamino)-3-(methylamino)propan-2-ol
CID 12700841

Frequently Asked Questions

What is the IUPAC name of 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol?
The IUPAC name of 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol (CID 62860043) is 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol.
What is the SMILES notation for 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol?
The canonical SMILES for 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol is CNCC(O)CN(C)CC1CCC1.
What is the InChIKey of 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol?
The InChIKey is IVAGVMDIKZALSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-11-6-10(13)8-12(2)7-9-4-3-5-9/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol?
1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol has a molecular weight of 186.30 g/mol, XLogP of 0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclobutylmethyl(methyl)amino]-3-(methylamino)propan-2-ol is sourced from PubChem (CID 62860043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).