3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol

C12H26N2O — CID 64786271

IUPAC3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCNC(C)(CO)CN(C)CC1CCC1
InChIInChI=1S/C12H26N2O/c1-4-13-12(2,10-15)9-14(3)8-11-6-5-7-11/h11,13,15H,4-10H2,1-3H3
InChIKeyAKPYVFBHBOIBIQ-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.08
Rot. Bonds7

About 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol

3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol (PubChem CID 64786271) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
PubChem CID64786271
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol
SMILESCCNC(C)(CO)CN(C)CC1CCC1
InChIInChI=1S/C12H26N2O/c1-4-13-12(2,10-15)9-14(3)8-11-6-5-7-11/h11,13,15H,4-10H2,1-3H3
InChIKeyAKPYVFBHBOIBIQ-UHFFFAOYSA-N
XLogP1.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(ethylamino)-2-methyl-3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]propan-1-ol
CID 64791463
3-[cyclohexylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64826426
3-[cyclopentylmethyl(methyl)amino]-2-(cyclopropylamino)-2-methylpropan-1-ol
CID 64787635
4-[cyclopentylmethyl(methyl)amino]-2-(ethylamino)-2-methylbutan-1-ol
CID 64787817
3-[cyclopropylmethyl(methyl)amino]-2-methyl-2-(propylamino)propan-1-ol
CID 64825469
2-(ethylamino)-2-methyl-3-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]propan-1-ol
CID 79317268
1-N-(cyclohexylmethyl)-2-N-ethyl-1-N,2-dimethylpropane-1,2-diamine
CID 62834837
5-[cyclopentylmethyl(methyl)amino]-2-methyl-2-(propylamino)pentan-1-ol
CID 64787636
4-[cyclobutylmethyl(methyl)amino]-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 64787804
2-(ethylamino)-2-methyl-3-[methyl(3-methylbutyl)amino]propan-1-ol
CID 64826613
6-[cyclobutylmethyl(methyl)amino]-2-(cyclopropylamino)-2-methylhexan-1-ol
CID 64786465
3-[cyclohexylmethyl(methyl)amino]-2-cyclopropyl-2-(ethylamino)propanoic acid
CID 63916273

Frequently Asked Questions

What is the IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The IUPAC name of 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol (CID 64786271) is 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol.
What is the SMILES notation for 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The canonical SMILES for 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol is CCNC(C)(CO)CN(C)CC1CCC1.
What is the InChIKey of 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
The InChIKey is AKPYVFBHBOIBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-13-12(2,10-15)9-14(3)8-11-6-5-7-11/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol?
3-[cyclobutylmethyl(methyl)amino]-2-(ethylamino)-2-methylpropan-1-ol has a molecular weight of 214.35 g/mol, XLogP of 1.08, 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-(ethylamino)-2-methylpropan-1-ol is sourced from PubChem (CID 64786271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).