2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol

C14H28N2O — CID 79855562

IUPAC2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol
SMILESCNC1C(CN(CCO)C2CC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-6-11(13(14)15-3)10-16(8-9-17)12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyDTCCXKQNTKXXDH-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.47
Rot. Bonds6

About 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol

2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol (PubChem CID 79855562) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol
PubChem CID79855562
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol
SMILESCNC1C(CN(CCO)C2CC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-6-11(13(14)15-3)10-16(8-9-17)12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyDTCCXKQNTKXXDH-UHFFFAOYSA-N
XLogP1.47
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79865497
2-[[3,3-dimethyl-2-(methylamino)cyclohexyl]methyl-methylamino]ethanol
CID 79853440
5-[[cyclopropyl(furan-2-ylmethyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 79855711
2-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-methylamino]propan-1-ol
CID 104554577
5-[[cyclopropyl(propyl)amino]methyl]-2,2-dimethylcyclopentan-1-ol
CID 79855583
2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
CID 102870950
5-[[cyclopropyl(cyclopropylmethyl)amino]methyl]-N-ethyl-2,2-dimethylcyclopentan-1-amine
CID 79855110
1-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl-methylamino]-2-methylpropan-2-ol
CID 79856035
2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
CID 104517048
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
CID 82743146
5-[[2-ethoxyethyl(methyl)amino]methyl]-N,2,2-trimethylcyclopentan-1-amine
CID 81074491
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methylthiolan-3-amine
CID 79865895

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol (CID 79855562) is 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol is CNC1C(CN(CCO)C2CC2)CCC1(C)C.
What is the InChIKey of 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol?
The InChIKey is DTCCXKQNTKXXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2)7-6-11(13(14)15-3)10-16(8-9-17)12-4-5-12/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol?
2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol has a molecular weight of 240.39 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]amino]ethanol is sourced from PubChem (CID 79855562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).