1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol

C12H26N2O — CID 112734110

IUPAC1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol
SMILESCCN1CCCC1CN(C)CC(C)(C)O
InChIInChI=1S/C12H26N2O/c1-5-14-8-6-7-11(14)9-13(4)10-12(2,3)15/h11,15H,5-10H2,1-4H3
InChIKeyNTDNJPCWVUKQDR-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.17
Rot. Bonds5

About 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol

1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol (PubChem CID 112734110) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol
PubChem CID112734110
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol
SMILESCCN1CCCC1CN(C)CC(C)(C)O
InChIInChI=1S/C12H26N2O/c1-5-14-8-6-7-11(14)9-13(4)10-12(2,3)15/h11,15H,5-10H2,1-4H3
InChIKeyNTDNJPCWVUKQDR-UHFFFAOYSA-N
XLogP1.17
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2,2-dimethylpropan-1-ol
CID 115277941
1-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-N,2,2,3-tetramethylbutane-1,3-diamine
CID 79318789
1-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-N,2-dimethylpentane-1,2-diamine
CID 79319921
methyl 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2,2-dimethylpropanoate
CID 79620923
2-amino-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropanenitrile
CID 79315150
3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2,2-dimethylpropanehydrazide
CID 79631822
N-tert-butyl-N'-[(1-ethylpyrrolidin-2-yl)methyl]-N'-methylethane-1,2-diamine
CID 79314054
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,2,2-trimethylpropanamide
CID 79312453
ethyl 2-amino-2-cyclopropyl-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]propanoate
CID 79309509
2-amino-5-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpentan-1-ol
CID 79317992
2-amino-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]propanoic acid
CID 79319869
4-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methyl-2-(propan-2-ylamino)butan-1-ol
CID 79317752

Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol (CID 112734110) is 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol is CCN1CCCC1CN(C)CC(C)(C)O.
What is the InChIKey of 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol?
The InChIKey is NTDNJPCWVUKQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-14-8-6-7-11(14)9-13(4)10-12(2,3)15/h11,15H,5-10H2,1-4H3.
What are the key properties of 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol?
1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol has a molecular weight of 214.35 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 112734110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).