N-benzyl-2-ethyl-1-phenylbutan-1-amine

C19H25N — CID 43734682

IUPACN-benzyl-2-ethyl-1-phenylbutan-1-amine
SMILESCCC(CC)C(NCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N/c1-3-17(4-2)19(18-13-9-6-10-14-18)20-15-16-11-7-5-8-12-16/h5-14,17,19-20H,3-4,15H2,1-2H3
InChIKeyIZZHOIYBKYMKCW-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.95
Rot. Bonds7

About N-benzyl-2-ethyl-1-phenylbutan-1-amine

N-benzyl-2-ethyl-1-phenylbutan-1-amine (PubChem CID 43734682) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is N-benzyl-2-ethyl-1-phenylbutan-1-amine.

Molecular Properties

Compound NameN-benzyl-2-ethyl-1-phenylbutan-1-amine
PubChem CID43734682
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC NameN-benzyl-2-ethyl-1-phenylbutan-1-amine
SMILESCCC(CC)C(NCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H25N/c1-3-17(4-2)19(18-13-9-6-10-14-18)20-15-16-11-7-5-8-12-16/h5-14,17,19-20H,3-4,15H2,1-2H3
InChIKeyIZZHOIYBKYMKCW-UHFFFAOYSA-N
XLogP4.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[[(2-ethyl-1-phenylbutyl)amino]methyl]phenol
CID 43734643
2-ethyl-1-phenyl-N-(thiophen-3-ylmethyl)butan-1-amine
CID 43734672
N,N'-bis[(4-ethylphenyl)methyl]-1,2-diphenylethane-1,2-diamine
CID 139633407
1-(benzylamino)-1-phenylpropan-2-ol
CID 71723704
2-ethyl-N-[(5-ethylthiophen-2-yl)methyl]-1-phenylbutan-1-amine
CID 63445722
4-[(benzylamino)-phenylmethyl]heptane-3,5-dione
CID 102397500
N-[(5-bromofuran-2-yl)methyl]-2-ethyl-1-phenylbutan-1-amine
CID 43734675
2-ethyl-N-[(5-iodofuran-2-yl)methyl]-1-phenylbutan-1-amine
CID 43788951
2-[(benzylamino)-phenylmethyl]propanedioic acid
CID 19764581
methyl (2R)-2-[(S)-(benzylamino)-phenylmethyl]-3-methylbutanoate
CID 102070939
ethyl (2R,3R)-3-(benzylamino)-2-methyl-3-phenylpropanoate
CID 100975099
3-(benzylamino)-2-hydroxy-3-phenylpropanoic acid
CID 21219515

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-ethyl-1-phenylbutan-1-amine?
The IUPAC name of N-benzyl-2-ethyl-1-phenylbutan-1-amine (CID 43734682) is N-benzyl-2-ethyl-1-phenylbutan-1-amine.
What is the SMILES notation for N-benzyl-2-ethyl-1-phenylbutan-1-amine?
The canonical SMILES for N-benzyl-2-ethyl-1-phenylbutan-1-amine is CCC(CC)C(NCc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-2-ethyl-1-phenylbutan-1-amine?
The InChIKey is IZZHOIYBKYMKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-3-17(4-2)19(18-13-9-6-10-14-18)20-15-16-11-7-5-8-12-16/h5-14,17,19-20H,3-4,15H2,1-2H3.
What are the key properties of N-benzyl-2-ethyl-1-phenylbutan-1-amine?
N-benzyl-2-ethyl-1-phenylbutan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.95, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-ethyl-1-phenylbutan-1-amine is sourced from PubChem (CID 43734682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).