2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide

C16H21N3O — CID 105379042

IUPAC2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide
SMILESCc1ccc2cc(CC(CN)C(=O)N(C)C)ccc2n1
InChIInChI=1S/C16H21N3O/c1-11-4-6-13-8-12(5-7-15(13)18-11)9-14(10-17)16(20)19(2)3/h4-8,14H,9-10,17H2,1-3H3
InChIKeyFRQAOOUMWWQISO-UHFFFAOYSA-N
MW271.36 g/mol
LogP1.75
Rot. Bonds4

About 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide

2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide (PubChem CID 105379042) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide
PubChem CID105379042
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide
SMILESCc1ccc2cc(CC(CN)C(=O)N(C)C)ccc2n1
InChIInChI=1S/C16H21N3O/c1-11-4-6-13-8-12(5-7-15(13)18-11)9-14(10-17)16(20)19(2)3/h4-8,14H,9-10,17H2,1-3H3
InChIKeyFRQAOOUMWWQISO-UHFFFAOYSA-N
XLogP1.75
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-(Dimethylamino)ethyl)acridine-4-carboxamide
CID 107805
SB 222200
CID 6604009
N-(3-(benzyl(methyl)amino)propyl)-9-chloro-5,6,7,8-tetrahydroacridine-2-carboxamide
CID 73349008
9-amino-N-(3-(dimethylamino)propyl)acridine-4-carboxamide
CID 150238
3-(5-{[4-(Aminomethyl)piperidin-1-YL]methyl}-1H-indol-2-YL)quinolin-2(1H)-one
CID 10156987
N-heptyl-7-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 10638726
N-((4-dimethylamino)butyl)-9-aminoacridine-4-carboxamide
CID 124660
9-Amino-N-(2-(dimethylamino)ethyl)-4-acridinecarboxamide
CID 128962
2-phenyl-N-(1-phenylethyl)quinoline-4-carboxamide
CID 2849628
5-(1,2-dithiolan-3-yl)-N-[2-(1,2,3,4-tetrahydroacridin-9-ylamino)ethyl]pentanamide
CID 11304963
5-(1,2-dithiolan-3-yl)-N-[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]pentanamide
CID 11316712
5-(1,2-dithiolan-3-yl)-N-[6-(1,2,3,4-tetrahydroacridin-9-ylamino)hexyl]pentanamide
CID 11352229

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide?
The IUPAC name of 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide (CID 105379042) is 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide.
What is the SMILES notation for 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide?
The canonical SMILES for 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide is Cc1ccc2cc(CC(CN)C(=O)N(C)C)ccc2n1.
What is the InChIKey of 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide?
The InChIKey is FRQAOOUMWWQISO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-11-4-6-13-8-12(5-7-15(13)18-11)9-14(10-17)16(20)19(2)3/h4-8,14H,9-10,17H2,1-3H3.
What are the key properties of 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide?
2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide has a molecular weight of 271.36 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N,N-dimethyl-3-(2-methylquinolin-6-yl)propanamide is sourced from PubChem (CID 105379042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).