2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol

C13H25NO — CID 104517048

IUPAC2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
SMILESCC1CCCCC1CN(CCO)C1CC1
InChIInChI=1S/C13H25NO/c1-11-4-2-3-5-12(11)10-14(8-9-15)13-6-7-13/h11-13,15H,2-10H2,1H3
InChIKeyUUAWJTWOTCKVTI-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.27
Rot. Bonds5

About 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol

2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol (PubChem CID 104517048) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
PubChem CID104517048
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol
SMILESCC1CCCCC1CN(CCO)C1CC1
InChIInChI=1S/C13H25NO/c1-11-4-2-3-5-12(11)10-14(8-9-15)13-6-7-13/h11-13,15H,2-10H2,1H3
InChIKeyUUAWJTWOTCKVTI-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 62610274
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2-[cyclobutyl-[[2-(methylamino)cyclohexyl]methyl]amino]ethanol
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2-[[cyclopropyl(2-hydroxyethyl)amino]methyl]-4-methylcyclohexan-1-ol
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CID 96553275
2-[cyclohexyl(2-hydroxyethyl)amino]ethanol;nickel
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2-[ethyl-(2-methylcyclohexyl)amino]ethanol
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2-[ethyl-[(1S,2S)-2-methylcyclohexyl]amino]ethanol
CID 129411602
2-[(2-amino-5-propan-2-ylcyclohexyl)methyl-cyclohexylamino]ethanol
CID 62707763
2-[[cyclohexyl(2-hydroxyethyl)amino]methyl]-4-propan-2-ylcyclohexan-1-ol
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2-[cyclohexyl-[[4-(methylamino)oxan-3-yl]methyl]amino]ethanol
CID 103059443

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol (CID 104517048) is 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol is CC1CCCCC1CN(CCO)C1CC1.
What is the InChIKey of 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol?
The InChIKey is UUAWJTWOTCKVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-11-4-2-3-5-12(11)10-14(8-9-15)13-6-7-13/h11-13,15H,2-10H2,1H3.
What are the key properties of 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol?
2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol has a molecular weight of 211.35 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl-[(2-methylcyclohexyl)methyl]amino]ethanol is sourced from PubChem (CID 104517048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).