4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline

C19H32N2 — CID 63816201

IUPAC4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline
SMILESCCC1CCC(N(C)c2ccc(CC(C)N)cc2C)CC1
InChIInChI=1S/C19H32N2/c1-5-16-6-9-18(10-7-16)21(4)19-11-8-17(12-14(19)2)13-15(3)20/h8,11-12,15-16,18H,5-7,9-10,13,20H2,1-4H3
InChIKeyIXGHTQUPAREXIS-UHFFFAOYSA-N
MW288.48 g/mol
LogP4.29
Rot. Bonds5

About 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline

4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline (PubChem CID 63816201) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline.

Molecular Properties

Compound Name4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline
PubChem CID63816201
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline
SMILESCCC1CCC(N(C)c2ccc(CC(C)N)cc2C)CC1
InChIInChI=1S/C19H32N2/c1-5-16-6-9-18(10-7-16)21(4)19-11-8-17(12-14(19)2)13-15(3)20/h8,11-12,15-16,18H,5-7,9-10,13,20H2,1-4H3
InChIKeyIXGHTQUPAREXIS-UHFFFAOYSA-N
XLogP4.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-aminopropyl)-N-cyclopentyl-N,2-dimethylaniline
CID 63786126
4-(2-aminopropyl)-N,N,2-trimethylaniline
CID 3043622
2-(2-aminopropyl)-5-chloro-N-(4-ethylcyclohexyl)-N-methylaniline
CID 114861531
4-(2-aminopropyl)-N-cyclopropyl-N-(2-methoxyethyl)-2-methylaniline
CID 63817388
N-[4-(2-aminopropyl)-2-chlorophenyl]-1-ethyl-N-methylpiperidin-4-amine
CID 81159630
4-(2-aminopropyl)-N-(1-methoxypropan-2-yl)-N,2-dimethylaniline
CID 55236420
4-(2-aminopropyl)-N-cyclopropyl-N-(cyclopropylmethyl)-2-fluoroaniline
CID 64521103
4-(2-aminopropyl)-2-chloro-N-methyl-N-(3-methylcyclohexyl)aniline
CID 81166154
4-(bromomethyl)-N-cyclobutyl-N,2-dimethylaniline
CID 107085198
4-(bromomethyl)-N-(4-ethylcyclohexyl)-2-fluoro-N-methylaniline
CID 107081550
4-(2-aminopropyl)-N-(cyclopropylmethyl)-2-fluoro-N-methylaniline
CID 55235260
4-(2-aminopropyl)-N,2-dimethyl-N-(oxan-2-ylmethyl)aniline
CID 63794010

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline?
The IUPAC name of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline (CID 63816201) is 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline.
What is the SMILES notation for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline?
The canonical SMILES for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline is CCC1CCC(N(C)c2ccc(CC(C)N)cc2C)CC1.
What is the InChIKey of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline?
The InChIKey is IXGHTQUPAREXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-16-6-9-18(10-7-16)21(4)19-11-8-17(12-14(19)2)13-15(3)20/h8,11-12,15-16,18H,5-7,9-10,13,20H2,1-4H3.
What are the key properties of 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline?
4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline has a molecular weight of 288.48 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopropyl)-N-(4-ethylcyclohexyl)-N,2-dimethylaniline is sourced from PubChem (CID 63816201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).