4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide

C16H20N4O — CID 63375694

IUPAC4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
SMILESCN(CCNC(=O)c1cc(N)c2ccccc2n1)C1CC1
InChIInChI=1S/C16H20N4O/c1-20(11-6-7-11)9-8-18-16(21)15-10-13(17)12-4-2-3-5-14(12)19-15/h2-5,10-11H,6-9H2,1H3,(H2,17,19)(H,18,21)
InChIKeyMCZQPBHNKJXYAN-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.64
Rot. Bonds5

About 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide

4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide (PubChem CID 63375694) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
PubChem CID63375694
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
SMILESCN(CCNC(=O)c1cc(N)c2ccccc2n1)C1CC1
InChIInChI=1S/C16H20N4O/c1-20(11-6-7-11)9-8-18-16(21)15-10-13(17)12-4-2-3-5-14(12)19-15/h2-5,10-11H,6-9H2,1H3,(H2,17,19)(H,18,21)
InChIKeyMCZQPBHNKJXYAN-UHFFFAOYSA-N
XLogP1.64
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(3-methylsulfonylpropyl)quinoline-2-carboxamide
CID 63375138
4-amino-N-(2-butoxyethyl)quinoline-2-carboxamide
CID 63375414
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)quinoline-2-carboxamide
CID 115485639
4-amino-N-[2-(methylamino)-2-oxoethyl]quinoline-2-carboxamide
CID 63375489
4-amino-N-(2-hydroxypropyl)quinoline-2-carboxamide
CID 113319901
4-amino-N-methyl-N-phenylquinoline-2-carboxamide
CID 63375205
2-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]-1,3-thiazole-4-carboxamide
CID 62975755
4-amino-N-(cyclobutylmethyl)-N-methylquinoline-2-carboxamide
CID 63375463
4-amino-N-[2-(1H-imidazol-2-yl)ethyl]quinoline-2-carboxamide
CID 115751977
4-amino-N-[2-(cyclopenten-1-yl)ethyl]quinoline-2-carboxamide
CID 103843001
4-amino-N-piperidin-4-ylquinoline-2-carboxamide
CID 71141710
4-amino-N-(2,2-dimethylbutyl)quinoline-2-carboxamide
CID 103461470

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide?
The IUPAC name of 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide (CID 63375694) is 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide is CN(CCNC(=O)c1cc(N)c2ccccc2n1)C1CC1.
What is the InChIKey of 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide?
The InChIKey is MCZQPBHNKJXYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(11-6-7-11)9-8-18-16(21)15-10-13(17)12-4-2-3-5-14(12)19-15/h2-5,10-11H,6-9H2,1H3,(H2,17,19)(H,18,21).
What are the key properties of 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide?
4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide is sourced from PubChem (CID 63375694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).