N-benzhydryl-N-ethylpyrrolidin-3-amine

C19H24N2 — CID 63299768

IUPACN-benzhydryl-N-ethylpyrrolidin-3-amine
SMILESCCN(C1CCNC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2/c1-2-21(18-13-14-20-15-18)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3
InChIKeyKUWGPPLAEYOQGC-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.46
Rot. Bonds5

About N-benzhydryl-N-ethylpyrrolidin-3-amine

N-benzhydryl-N-ethylpyrrolidin-3-amine (PubChem CID 63299768) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-benzhydryl-N-ethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-benzhydryl-N-ethylpyrrolidin-3-amine
PubChem CID63299768
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-benzhydryl-N-ethylpyrrolidin-3-amine
SMILESCCN(C1CCNC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H24N2/c1-2-21(18-13-14-20-15-18)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3
InChIKeyKUWGPPLAEYOQGC-UHFFFAOYSA-N
XLogP3.46
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(3-methyl-1-phenylbutyl)pyrrolidin-3-amine
CID 63299236
N-ethyl-N-(1-phenylethyl)piperidin-3-amine
CID 63643629
N-ethyl-N-(4-phenylbutan-2-yl)pyrrolidin-3-amine
CID 63301804
N-ethyl-N-[furan-2-yl(phenyl)methyl]azetidin-3-amine
CID 66184000
N-[1-(2-chlorophenyl)ethyl]-N-ethylpyrrolidin-3-amine
CID 63299507
N-(3-methyl-1-phenylbutyl)-N-propylpyrrolidin-3-amine
CID 63300659
(3S)-N-benzyl-N-propan-2-ylpyrrolidin-3-amine
CID 66569418
N-ethyl-N-[1-(3-methoxyphenyl)ethyl]pyrrolidin-3-amine
CID 63301494
(3S)-N-benzyl-N-ethylpyrrolidin-3-amine
CID 66569411
N-benzyl-N-ethylpyrrolidin-3-amine
CID 53410837
2-(diethylamino)-N-methyl-2-phenyl-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 119551607
N-(1-phenylpropyl)-N-propylpiperidin-3-amine
CID 63638122

Frequently Asked Questions

What is the IUPAC name of N-benzhydryl-N-ethylpyrrolidin-3-amine?
The IUPAC name of N-benzhydryl-N-ethylpyrrolidin-3-amine (CID 63299768) is N-benzhydryl-N-ethylpyrrolidin-3-amine.
What is the SMILES notation for N-benzhydryl-N-ethylpyrrolidin-3-amine?
The canonical SMILES for N-benzhydryl-N-ethylpyrrolidin-3-amine is CCN(C1CCNC1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-benzhydryl-N-ethylpyrrolidin-3-amine?
The InChIKey is KUWGPPLAEYOQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-2-21(18-13-14-20-15-18)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,18-20H,2,13-15H2,1H3.
What are the key properties of N-benzhydryl-N-ethylpyrrolidin-3-amine?
N-benzhydryl-N-ethylpyrrolidin-3-amine has a molecular weight of 280.42 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzhydryl-N-ethylpyrrolidin-3-amine is sourced from PubChem (CID 63299768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).