N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine

C17H34N2 — CID 79056243

IUPACN-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine
SMILESCCNC(C1CCC(C)CC1)C(C)(C)N1CCCC1
InChIInChI=1S/C17H34N2/c1-5-18-16(15-10-8-14(2)9-11-15)17(3,4)19-12-6-7-13-19/h14-16,18H,5-13H2,1-4H3
InChIKeyDIKXYAQRJJLYQG-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds5

About N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine

N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 79056243) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID79056243
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC NameN-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine
SMILESCCNC(C1CCC(C)CC1)C(C)(C)N1CCCC1
InChIInChI=1S/C17H34N2/c1-5-18-16(15-10-8-14(2)9-11-15)17(3,4)19-12-6-7-13-19/h14-16,18H,5-13H2,1-4H3
InChIKeyDIKXYAQRJJLYQG-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-N-ethyl-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79052377
2-methyl-1-(4-methylcyclohexyl)-N-propyl-2-pyrrolidin-1-ylbutan-1-amine
CID 79059842
2-methyl-1-(4-methylcyclohexyl)-2-morpholin-4-yl-N-propylpropan-1-amine
CID 79051479
1-cyclopropyl-N,2-dimethyl-2-pyrrolidin-1-ylpropan-1-amine
CID 79056145
1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylbutan-2-amine
CID 79056065
N-ethyl-2-methyl-1-(3-methylcyclohexyl)-2-pyrrolidin-1-ylbutan-1-amine
CID 79069201
1-cyclopentyl-N,2-dimethyl-2-pyrrolidin-1-ylpropan-1-amine
CID 79056224
2-(azepan-1-yl)-2-methyl-1-(oxolan-3-yl)-N-propylpropan-1-amine
CID 79051831
N-ethyl-2-methyl-1-(3-methylcyclohexyl)-2-piperidin-1-ylbutan-1-amine
CID 79060672
2-methyl-1-(oxan-3-yl)-2-piperidin-1-yl-N-propylpropan-1-amine
CID 107136554
N,2-diethyl-1-(3-methylcyclohexyl)-2-pyrrolidin-1-ylbutan-1-amine
CID 79057396
N-ethyl-1-(3-ethylcyclohexyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79051624

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine (CID 79056243) is N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine is CCNC(C1CCC(C)CC1)C(C)(C)N1CCCC1.
What is the InChIKey of N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is DIKXYAQRJJLYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-18-16(15-10-8-14(2)9-11-15)17(3,4)19-12-6-7-13-19/h14-16,18H,5-13H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine?
N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-1-(4-methylcyclohexyl)-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 79056243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).