N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide

C16H19N3O — CID 63375436

IUPACN-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide
SMILESCCN(C(=O)c1cc(NC)c2ccccc2n1)C1CC1
InChIInChI=1S/C16H19N3O/c1-3-19(11-8-9-11)16(20)15-10-14(17-2)12-6-4-5-7-13(12)18-15/h4-7,10-11H,3,8-9H2,1-2H3,(H,17,18)
InChIKeyBVMPERNCMFDFSU-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.90
Rot. Bonds4

About N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide

N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide (PubChem CID 63375436) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide
PubChem CID63375436
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide
SMILESCCN(C(=O)c1cc(NC)c2ccccc2n1)C1CC1
InChIInChI=1S/C16H19N3O/c1-3-19(11-8-9-11)16(20)15-10-14(17-2)12-6-4-5-7-13(12)18-15/h4-7,10-11H,3,8-9H2,1-2H3,(H,17,18)
InChIKeyBVMPERNCMFDFSU-UHFFFAOYSA-N
XLogP2.90
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-N-ethyl-1-(methylamino)isoquinoline-3-carboxamide
CID 62170487
N-methyl-4-(methylamino)-N-(2-methylsulfanylethyl)quinoline-2-carboxamide
CID 115987219
N-[3-(dimethylamino)propyl]-4-(methylamino)quinoline-2-carboxamide
CID 63375251
4-chloro-N-cyclopropyl-N-(2-methylpropyl)quinoline-2-carboxamide
CID 63376080
4-(methylamino)-N-(3-methylcyclopentyl)quinoline-2-carboxamide
CID 114540556
4-hydrazinyl-N,N-dipropylquinoline-2-carboxamide
CID 63375200
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)quinoline-2-carboxamide
CID 82940781
N-cyclopropyl-N-ethyl-6-(methylamino)pyridazine-3-carboxamide
CID 62168086
4-(methylamino)-N-(1H-pyrazol-4-ylmethyl)quinoline-2-carboxamide
CID 63375555
N-(1-cyclopropylethyl)-4-hydrazinyl-N-methylquinoline-2-carboxamide
CID 63375607
(3-hydroxy-3-methylpyrrolidin-1-yl)-[4-(methylamino)quinolin-2-yl]methanone
CID 103358198
N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-(methylamino)quinoline-2-carboxamide
CID 63375460

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide (CID 63375436) is N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide is CCN(C(=O)c1cc(NC)c2ccccc2n1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide?
The InChIKey is BVMPERNCMFDFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-19(11-8-9-11)16(20)15-10-14(17-2)12-6-4-5-7-13(12)18-15/h4-7,10-11H,3,8-9H2,1-2H3,(H,17,18).
What are the key properties of N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide?
N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-4-(methylamino)quinoline-2-carboxamide is sourced from PubChem (CID 63375436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).