1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide

C19H25N3O — CID 4784922

IUPAC1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide
SMILESCc1cc(N2CCC(C(N)=O)CC2)nc2c(C(C)C)cccc12
InChIInChI=1S/C19H25N3O/c1-12(2)15-5-4-6-16-13(3)11-17(21-18(15)16)22-9-7-14(8-10-22)19(20)23/h4-6,11-12,14H,7-10H2,1-3H3,(H2,20,23)
InChIKeyVJQIGQPVNQXKKT-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.37
Rot. Bonds3

About 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide

1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide (PubChem CID 4784922) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide
PubChem CID4784922
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide
SMILESCc1cc(N2CCC(C(N)=O)CC2)nc2c(C(C)C)cccc12
InChIInChI=1S/C19H25N3O/c1-12(2)15-5-4-6-16-13(3)11-17(21-18(15)16)22-9-7-14(8-10-22)19(20)23/h4-6,11-12,14H,7-10H2,1-3H3,(H2,20,23)
InChIKeyVJQIGQPVNQXKKT-UHFFFAOYSA-N
XLogP3.37
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-methyl-8-propan-2-ylquinolin-2-yl)sulfanylacetyl]piperidine-4-carboxamide
CID 25349077
1-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 133313226
1-[2-(dimethylamino)-6-propan-2-ylpyrimidin-4-yl]piperidine-4-carboxamide
CID 154838840
4,8-dimethyl-2-piperidin-1-ylquinoline;2,2,2-trifluoroacetic acid
CID 46891914
6-(4-carbamoylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 55053558
1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide
CID 80917008
1-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone
CID 108731248
1-[2-(4-chlorophenyl)-8-methylquinolin-4-yl]piperidine-4-carboxamide
CID 70458495
1-(2-hydrazinyl-6-methylpyrimidin-4-yl)piperidine-4-carboxamide
CID 80917080
2-[4-(4,8-dimethylquinolin-2-yl)piperazin-1-yl]acetic acid
CID 82166224
1-[4-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]quinolin-2-yl]piperidine-4-carboxamide
CID 50832335
4-(4,8-dimethylquinolin-2-yl)morpholine
CID 798855

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide (CID 4784922) is 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide is Cc1cc(N2CCC(C(N)=O)CC2)nc2c(C(C)C)cccc12.
What is the InChIKey of 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide?
The InChIKey is VJQIGQPVNQXKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-12(2)15-5-4-6-16-13(3)11-17(21-18(15)16)22-9-7-14(8-10-22)19(20)23/h4-6,11-12,14H,7-10H2,1-3H3,(H2,20,23).
What are the key properties of 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide?
1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide has a molecular weight of 311.43 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-8-propan-2-ylquinolin-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 4784922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).