N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide

C15H24N4O2 — CID 43575674

IUPACN-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide
SMILESCCN(CC(=O)NC)C(C)C(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-3)11(2)15(21)18-13-7-5-12(9-16)6-8-13/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyRBUJPIABZFWBMT-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.54
Rot. Bonds7

About N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide

N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide (PubChem CID 43575674) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide
PubChem CID43575674
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide
SMILESCCN(CC(=O)NC)C(C)C(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-3)11(2)15(21)18-13-7-5-12(9-16)6-8-13/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyRBUJPIABZFWBMT-UHFFFAOYSA-N
XLogP0.54
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(aminomethyl)phenyl]-2-[1-(dimethylamino)propan-2-yl-ethylamino]acetamide
CID 103187880
2-[ethyl-[2-(4-methoxyanilino)-2-oxoethyl]amino]-N-(4-ethylphenyl)propanamide
CID 18078718
2-[ethyl-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]amino]-N-(4-ethylphenyl)propanamide
CID 112769362
N-[4-(aminomethyl)phenyl]-2-[cyclopropylmethyl(propyl)amino]propanamide
CID 43479003
2-(diethylamino)-N-(4-methylphenyl)propanamide
CID 24843836
4-[2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]propanoylamino]benzamide
CID 112769376
(2S)-2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-ethylpropanamide
CID 8791504
N-[4-(aminomethyl)phenyl]-2-[methyl(3-methylbutyl)amino]propanamide
CID 61425557
N-[4-(aminomethyl)phenyl]-2-cyanopropanamide
CID 82506537
(2S)-2-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]propanamide
CID 8779615
N-[4-(aminomethyl)phenyl]-2-[3-(dimethylamino)propyl-methylamino]propanamide
CID 63693223
N-[4-(aminomethyl)phenyl]-2-[methyl(propan-2-yl)amino]acetamide
CID 16790280

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide (CID 43575674) is N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide is CCN(CC(=O)NC)C(C)C(=O)Nc1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide?
The InChIKey is RBUJPIABZFWBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-3)11(2)15(21)18-13-7-5-12(9-16)6-8-13/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide?
N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide has a molecular weight of 292.38 g/mol, XLogP of 0.54, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]propanamide is sourced from PubChem (CID 43575674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).