N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine

C18H35N — CID 81028892

IUPACN-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCCC1CCC(C2CCCC2CNC(C)(C)C)CC1
InChIInChI=1S/C18H35N/c1-5-14-9-11-15(12-10-14)17-8-6-7-16(17)13-19-18(2,3)4/h14-17,19H,5-13H2,1-4H3
InChIKeyRVZZWHXPTCRQRC-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.01
Rot. Bonds4

About N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine

N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine (PubChem CID 81028892) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine
PubChem CID81028892
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC NameN-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine
SMILESCCC1CCC(C2CCCC2CNC(C)(C)C)CC1
InChIInChI=1S/C18H35N/c1-5-14-9-11-15(12-10-14)17-8-6-7-16(17)13-19-18(2,3)4/h14-17,19H,5-13H2,1-4H3
InChIKeyRVZZWHXPTCRQRC-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
CID 81025228
N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 81028909
2-methyl-N-[[2-(3-methylcyclohexyl)cyclopentyl]methyl]propan-2-amine
CID 81026999
N-[[4-ethyl-2-(oxan-4-yl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81029514
N-[(4-tert-butyl-2-cyclopropylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 81030772
N-[(2-cyclopropylcyclopentyl)methyl]propan-1-amine
CID 81033857
N-[(2-tert-butyl-4-ethylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 81030105
6-(4-ethylcyclohexyl)-1,7-dimethyl-1,2,3,3a,4,5,6,7,8,9,10,10a-dodecahydrocyclopenta[9]annulene
CID 58552213
2-methyl-N-[(2-pentan-3-ylcyclopentyl)methyl]propan-2-amine
CID 81027395
N-[[2-(4-tert-butylcyclohexyl)cyclopropyl]methyl]-2-methylpropan-2-amine
CID 104575933
(1S,4aR,8aR)-1-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 165360268
N-[[2-(3-ethylcyclohexyl)cyclopentyl]methyl]cyclopropanamine
CID 81034069

Frequently Asked Questions

What is the IUPAC name of N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine (CID 81028892) is N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine is CCC1CCC(C2CCCC2CNC(C)(C)C)CC1.
What is the InChIKey of N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
The InChIKey is RVZZWHXPTCRQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-5-14-9-11-15(12-10-14)17-8-6-7-16(17)13-19-18(2,3)4/h14-17,19H,5-13H2,1-4H3.
What are the key properties of N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine?
N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine has a molecular weight of 265.48 g/mol, XLogP of 5.01, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 81028892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).