N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline

C19H26N2 — CID 43284092

IUPACN-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)Cc1ccccc1
InChIInChI=1S/C19H26N2/c1-4-14-20-16(2)18-12-8-9-13-19(18)21(3)15-17-10-6-5-7-11-17/h5-13,16,20H,4,14-15H2,1-3H3
InChIKeyMIFUJBXQJGMPLN-UHFFFAOYSA-N
MW282.43 g/mol
LogP4.38
Rot. Bonds7

About N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline

N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline (PubChem CID 43284092) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline
PubChem CID43284092
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline
SMILESCCCNC(C)c1ccccc1N(C)Cc1ccccc1
InChIInChI=1S/C19H26N2/c1-4-14-20-16(2)18-12-8-9-13-19(18)21(3)15-17-10-6-5-7-11-17/h5-13,16,20H,4,14-15H2,1-3H3
InChIKeyMIFUJBXQJGMPLN-UHFFFAOYSA-N
XLogP4.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[N-methyl-2-[1-(propylamino)ethyl]anilino]propanenitrile
CID 43284304
N-ethyl-N-phenyl-2-[1-(propylamino)ethyl]aniline
CID 43284277
N-cyclopentyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284594
2-[1-(ethylamino)ethyl]-N-methyl-N-(thiophen-3-ylmethyl)aniline
CID 43528292
N-methyl-N-[2-[1-(propylamino)ethyl]phenyl]cycloheptanamine
CID 43614164
N-cyclohexyl-N-methyl-2-[1-(propylamino)ethyl]aniline
CID 43284184
N-ethyl-2-[1-(ethylamino)ethyl]-N-methylaniline
CID 43284520
N,N-bis(prop-2-enyl)-2-[1-(propylamino)ethyl]aniline
CID 43283869
N-benzyl-N-methyl-2-[(propan-2-ylamino)methyl]aniline
CID 43280656
N-methyl-N-(2-methylcyclohexyl)-2-[1-(propylamino)ethyl]aniline
CID 63532695
N-methyl-1,1-dioxo-N-[2-[1-(propylamino)ethyl]phenyl]thiolan-3-amine
CID 43648827
N,2-dimethyl-N-[2-[1-(propylamino)ethyl]phenyl]oxolan-3-amine
CID 82739333

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The IUPAC name of N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline (CID 43284092) is N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline.
What is the SMILES notation for N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The canonical SMILES for N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline is CCCNC(C)c1ccccc1N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
The InChIKey is MIFUJBXQJGMPLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-4-14-20-16(2)18-12-8-9-13-19(18)21(3)15-17-10-6-5-7-11-17/h5-13,16,20H,4,14-15H2,1-3H3.
What are the key properties of N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline?
N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline has a molecular weight of 282.43 g/mol, XLogP of 4.38, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[1-(propylamino)ethyl]aniline is sourced from PubChem (CID 43284092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).