N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline

C19H30N2 — CID 143013293

IUPACN-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline
SMILESC=C(c1cc(C)ccc1NCC1CC1)N(CCC)CCC
InChIInChI=1S/C19H30N2/c1-5-11-21(12-6-2)16(4)18-13-15(3)7-10-19(18)20-14-17-8-9-17/h7,10,13,17,20H,4-6,8-9,11-12,14H2,1-3H3
InChIKeyBYSIQYHYUGRQMK-UHFFFAOYSA-N
MW286.46 g/mol
LogP4.91
Rot. Bonds9

About N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline

N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline (PubChem CID 143013293) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline
PubChem CID143013293
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC NameN-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline
SMILESC=C(c1cc(C)ccc1NCC1CC1)N(CCC)CCC
InChIInChI=1S/C19H30N2/c1-5-11-21(12-6-2)16(4)18-13-15(3)7-10-19(18)20-14-17-8-9-17/h7,10,13,17,20H,4-6,8-9,11-12,14H2,1-3H3
InChIKeyBYSIQYHYUGRQMK-UHFFFAOYSA-N
XLogP4.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-[(4-methylcyclohexyl)methylamino]benzoic acid
CID 55225101
2-[(4-ethylcyclohexyl)methylamino]-5-methylbenzenecarbothioamide
CID 107928838
N-(cyclopropylmethyl)-2-hydrazinyl-5-methyl-N-propylbenzamide
CID 62511311
2-(cyclobutylmethylamino)-5-methylbenzoic acid
CID 62514472
[2-(cyclopropylmethylamino)-5-methylphenyl]-phenylmethanone
CID 163846803
methyl 5-methyl-2-[(1-methylpiperidin-4-yl)methylamino]benzoate
CID 62655467
N-(cyclopropylmethyl)-5-methyl-2-propoxyaniline
CID 83961753
N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
CID 62509873
2-(ethylamino)-N-(2-hydroxyethyl)-5-methyl-N-propylbenzamide
CID 62510294
5-methyl-2-(methylamino)-N,N-dipropylbenzamide
CID 55082842
1-N-(cyclopentylmethyl)-4-methylbenzene-1,2-diamine
CID 43370979
4-[(2-amino-5-methylanilino)methyl]cyclohexan-1-ol
CID 106120121

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline?
The IUPAC name of N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline (CID 143013293) is N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline?
The canonical SMILES for N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline is C=C(c1cc(C)ccc1NCC1CC1)N(CCC)CCC.
What is the InChIKey of N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline?
The InChIKey is BYSIQYHYUGRQMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-5-11-21(12-6-2)16(4)18-13-15(3)7-10-19(18)20-14-17-8-9-17/h7,10,13,17,20H,4-6,8-9,11-12,14H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline?
N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline has a molecular weight of 286.46 g/mol, XLogP of 4.91, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[1-(dipropylamino)ethenyl]-4-methylaniline is sourced from PubChem (CID 143013293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).