2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol

C14H27NO — CID 64751878

IUPAC2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
SMILESCCN(CC1CC1)C1C(C)CC(C)CC1O
InChIInChI=1S/C14H27NO/c1-4-15(9-12-5-6-12)14-11(3)7-10(2)8-13(14)16/h10-14,16H,4-9H2,1-3H3
InChIKeyRNRQBRLNEQYBBD-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.51
Rot. Bonds4

About 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol

2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol (PubChem CID 64751878) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
PubChem CID64751878
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
SMILESCCN(CC1CC1)C1C(C)CC(C)CC1O
InChIInChI=1S/C14H27NO/c1-4-15(9-12-5-6-12)14-11(3)7-10(2)8-13(14)16/h10-14,16H,4-9H2,1-3H3
InChIKeyRNRQBRLNEQYBBD-UHFFFAOYSA-N
XLogP2.51
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-ethoxyethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol
CID 64751103
2-[ethyl(pyridin-4-ylmethyl)amino]-3,5-dimethylcyclohexan-1-ol
CID 64753453
2-N-(cyclopropylmethyl)-3,5-dimethyl-1-N,2-N-dipropylcyclohexane-1,2-diamine
CID 64752522
2-[ethyl(1-methoxypropan-2-yl)amino]-3,5-dimethylcyclohexan-1-ol
CID 64752459
3,5-dimethyl-2-[propan-2-yl(propyl)amino]cyclohexan-1-ol
CID 64753449
3,5-dimethyl-2-[methyl(pentyl)amino]cyclohexan-1-ol
CID 64751671
3,5-dimethyl-2-[2-methylpropyl(pentan-3-yl)amino]cyclohexan-1-ol
CID 79483325
2-[cyclopropylmethyl-(3-methylcyclobutyl)amino]acetic acid
CID 103565060
2-(2-cyclopropylethoxy)-3,5-dimethylcyclohexan-1-ol
CID 106203905
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-1-N-ethyl-3,5-dimethylcyclohexane-1,2-diamine
CID 64751181
2-[cyclopropylmethyl-(3,5-dimethylcyclohexyl)amino]acetic acid
CID 64728458
2,5-dimethylcyclohexan-1-ol;propane
CID 142087287

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The IUPAC name of 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol (CID 64751878) is 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol.
What is the SMILES notation for 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The canonical SMILES for 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol is CCN(CC1CC1)C1C(C)CC(C)CC1O.
What is the InChIKey of 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
The InChIKey is RNRQBRLNEQYBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-15(9-12-5-6-12)14-11(3)7-10(2)8-13(14)16/h10-14,16H,4-9H2,1-3H3.
What are the key properties of 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol?
2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropylmethyl(ethyl)amino]-3,5-dimethylcyclohexan-1-ol is sourced from PubChem (CID 64751878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).