4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine

C18H37N — CID 65424745

IUPAC4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine
SMILESCCCNC(CCC(C)C)C1CCC(CCC)CC1
InChIInChI=1S/C18H37N/c1-5-7-16-9-11-17(12-10-16)18(19-14-6-2)13-8-15(3)4/h15-19H,5-14H2,1-4H3
InChIKeyHVZCNYZEFAFSME-UHFFFAOYSA-N
MW267.50 g/mol
LogP5.40
Rot. Bonds9

About 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine

4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine (PubChem CID 65424745) has the molecular formula C18H37N and a molecular weight of 267.50 g/mol. Its IUPAC name is 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine
PubChem CID65424745
Molecular FormulaC18H37N
Molecular Weight267.50 g/mol
Exact Mass267.29
IUPAC Name4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine
SMILESCCCNC(CCC(C)C)C1CCC(CCC)CC1
InChIInChI=1S/C18H37N/c1-5-7-16-9-11-17(12-10-16)18(19-14-6-2)13-8-15(3)4/h15-19H,5-14H2,1-4H3
InChIKeyHVZCNYZEFAFSME-UHFFFAOYSA-N
XLogP5.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.50
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-N-propyl-1-(4-propylcyclohexyl)hexan-1-amine
CID 65423977
3-cyclopentyl-1-cyclopropyl-N-propylpropan-1-amine
CID 63354880
N-propyl-1-(4-propylcyclohexyl)pent-3-yn-1-amine
CID 65425333
1-(4-butylcyclohexyl)-N,4-dimethylpentan-1-amine
CID 115834392
1-(4-ethylcyclohexyl)-4-methoxy-N-propylpentan-1-amine
CID 105155222
1-cyclopropyl-N-propylhexan-1-amine
CID 62600983
N-ethyl-1-(4-propylcyclohexyl)octan-1-amine
CID 65423776
1-(4-butylcyclohexyl)-N-propylhex-5-en-1-amine
CID 104987009
1-(1,1-dioxothiolan-3-yl)-4-methyl-N-propylpentan-1-amine
CID 113289799
N-[2-cyclopropyl-1-(4-methylcyclohexyl)ethyl]propan-1-amine
CID 64907023
N-methyl-1-(4-propylcyclohexyl)butan-1-amine
CID 65423384
1-cyclopropyl-N-propyltridecan-1-amine
CID 63413531

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine?
The IUPAC name of 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine (CID 65424745) is 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine.
What is the SMILES notation for 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine?
The canonical SMILES for 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine is CCCNC(CCC(C)C)C1CCC(CCC)CC1.
What is the InChIKey of 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine?
The InChIKey is HVZCNYZEFAFSME-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N/c1-5-7-16-9-11-17(12-10-16)18(19-14-6-2)13-8-15(3)4/h15-19H,5-14H2,1-4H3.
What are the key properties of 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine?
4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine has a molecular weight of 267.50 g/mol, XLogP of 5.40, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propyl-1-(4-propylcyclohexyl)pentan-1-amine is sourced from PubChem (CID 65424745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).