N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide

C16H24N2O — CID 55047703

IUPACN-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESCCCN(C(=O)c1cccc2c1NCCC2)C(C)C
InChIInChI=1S/C16H24N2O/c1-4-11-18(12(2)3)16(19)14-9-5-7-13-8-6-10-17-15(13)14/h5,7,9,12,17H,4,6,8,10-11H2,1-3H3
InChIKeyZHFWKPBBFKSRIG-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.31
Rot. Bonds4

About N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide

N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide (PubChem CID 55047703) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide.

Molecular Properties

Compound NameN-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
PubChem CID55047703
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESCCCN(C(=O)c1cccc2c1NCCC2)C(C)C
InChIInChI=1S/C16H24N2O/c1-4-11-18(12(2)3)16(19)14-9-5-7-13-8-6-10-17-15(13)14/h5,7,9,12,17H,4,6,8,10-11H2,1-3H3
InChIKeyZHFWKPBBFKSRIG-UHFFFAOYSA-N
XLogP3.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213109
N-(2,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 64599539
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62215091
N-(3-ethylpentan-3-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 65041181
N-(2-ethylhexyl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 107815415
N-methyl-1,2,3,4-tetrahydroquinoline-8-carboxamide;hydrochloride
CID 146675579
3-ethyl-4-(1,2,3,4-tetrahydroquinoline-8-carbonyl)piperazin-2-one
CID 63603518
(4-propylpiperazin-1-yl)-(1,2,3,4-tetrahydroquinolin-8-yl)methanone
CID 62213645
N-methyl-N-[(1-methylimidazol-2-yl)methyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 63025604
N-[2-(3-methylbutoxy)ethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62215094
[4-(1-hydroxyethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-8-yl)methanone
CID 106836042
N-(1-pyrazol-1-ylpropan-2-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213653

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The IUPAC name of N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide (CID 55047703) is N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide.
What is the SMILES notation for N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The canonical SMILES for N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide is CCCN(C(=O)c1cccc2c1NCCC2)C(C)C.
What is the InChIKey of N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The InChIKey is ZHFWKPBBFKSRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-11-18(12(2)3)16(19)14-9-5-7-13-8-6-10-17-15(13)14/h5,7,9,12,17H,4,6,8,10-11H2,1-3H3.
What are the key properties of N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide?
N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-propyl-1,2,3,4-tetrahydroquinoline-8-carboxamide is sourced from PubChem (CID 55047703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).