1-cyclopropyl-2-ethyl-N-propylhexan-1-amine

C14H29N — CID 104994116

IUPAC1-cyclopropyl-2-ethyl-N-propylhexan-1-amine
SMILESCCCCC(CC)C(NCCC)C1CC1
InChIInChI=1S/C14H29N/c1-4-7-8-12(6-3)14(13-9-10-13)15-11-5-2/h12-15H,4-11H2,1-3H3
InChIKeyWIUAKDLYRDKQSN-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.98
Rot. Bonds9

About 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine

1-cyclopropyl-2-ethyl-N-propylhexan-1-amine (PubChem CID 104994116) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-2-ethyl-N-propylhexan-1-amine
PubChem CID104994116
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name1-cyclopropyl-2-ethyl-N-propylhexan-1-amine
SMILESCCCCC(CC)C(NCCC)C1CC1
InChIInChI=1S/C14H29N/c1-4-7-8-12(6-3)14(13-9-10-13)15-11-5-2/h12-15H,4-11H2,1-3H3
InChIKeyWIUAKDLYRDKQSN-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-cyclopropyl-2-ethylhexyl)hydrazine
CID 105314540
1-cyclohexyl-2-methyl-N-propylhexan-1-amine
CID 114246260
1-(4-methylcyclohexyl)-N-propylpentan-1-amine
CID 63415743
2-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-N-propylbutan-1-amine
CID 112681595
1-(4-butylcyclohexyl)-2-methyl-N-propylpropan-1-amine
CID 114978751
1-cyclopropyl-3-ethyl-N-propylheptan-1-amine
CID 63413488
[1-(3,4-dimethylcyclohexyl)-2-ethylhexyl]hydrazine
CID 105312397
1-cyclopropyl-N-propylhexan-1-amine
CID 62600983
5-ethyl-N-propyltetradecan-6-amine
CID 115835262
1-cyclopropyl-N-propyltridecan-1-amine
CID 63413531
1-(4-ethylcyclohexyl)-2,3-dimethyl-N-propylbutan-1-amine
CID 104990778
N-[1-(4-ethylcyclohexyl)-2,2-dimethoxyethyl]propan-1-amine
CID 79493283

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine?
The IUPAC name of 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine (CID 104994116) is 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine.
What is the SMILES notation for 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine?
The canonical SMILES for 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine is CCCCC(CC)C(NCCC)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine?
The InChIKey is WIUAKDLYRDKQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-7-8-12(6-3)14(13-9-10-13)15-11-5-2/h12-15H,4-11H2,1-3H3.
What are the key properties of 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine?
1-cyclopropyl-2-ethyl-N-propylhexan-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.98, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-ethyl-N-propylhexan-1-amine is sourced from PubChem (CID 104994116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).