1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine

C18H29N — CID 64903846

IUPAC1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine
SMILESCCNC(CC1CC1)C(CC)(CC)c1ccccc1
InChIInChI=1S/C18H29N/c1-4-18(5-2,16-10-8-7-9-11-16)17(19-6-3)14-15-12-13-15/h7-11,15,17,19H,4-6,12-14H2,1-3H3
InChIKeySJWYXJUPSQTNJH-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.52
Rot. Bonds8

About 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine

1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine (PubChem CID 64903846) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine
PubChem CID64903846
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine
SMILESCCNC(CC1CC1)C(CC)(CC)c1ccccc1
InChIInChI=1S/C18H29N/c1-4-18(5-2,16-10-8-7-9-11-16)17(19-6-3)14-15-12-13-15/h7-11,15,17,19H,4-6,12-14H2,1-3H3
InChIKeySJWYXJUPSQTNJH-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,3-diethyl-7-methyl-3-phenyloctan-4-amine
CID 63417594
N,3-diethyl-1-methoxy-3-phenylpentan-2-amine
CID 79575431
1-cyclohexyl-N,2-diethyl-2-phenylbutan-1-amine
CID 63417640
N,5-diethyl-1-methoxy-5-phenylheptan-4-amine
CID 115608699
2-ethyl-N-methyl-1-(4-methylcyclohexyl)-2-phenylbutan-1-amine
CID 64774837
5-ethyl-2-methyl-5-phenyl-N-propylheptan-4-amine
CID 63417732
1-cyclohexyl-2-ethyl-2-phenylbutan-1-amine
CID 63418081
5-ethyl-5-phenyl-N-propylhept-1-yn-4-amine
CID 55180393
[2-ethyl-1-(oxolan-3-yl)-2-phenylbutyl]hydrazine
CID 105217689
(5-ethyl-2-methyl-5-phenylhept-1-en-4-yl)hydrazine
CID 105217758
1-cyclopentyl-N-ethyl-3-methoxy-3-methylbutan-2-amine
CID 79197910
N-ethyl-2,5-dimethyl-2,5-diphenylhexan-3-amine
CID 154638784

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine?
The IUPAC name of 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine (CID 64903846) is 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine?
The canonical SMILES for 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine is CCNC(CC1CC1)C(CC)(CC)c1ccccc1.
What is the InChIKey of 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine?
The InChIKey is SJWYXJUPSQTNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-4-18(5-2,16-10-8-7-9-11-16)17(19-6-3)14-15-12-13-15/h7-11,15,17,19H,4-6,12-14H2,1-3H3.
What are the key properties of 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine?
1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine has a molecular weight of 259.44 g/mol, XLogP of 4.52, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N,3-diethyl-3-phenylpentan-2-amine is sourced from PubChem (CID 64903846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).