N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide

C19H20N2O — CID 126807843

IUPACN-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide
SMILESO=C(NCC1(c2ccccn2)CC1)c1cccc2c1CCC2
InChIInChI=1S/C19H20N2O/c22-18(16-8-4-6-14-5-3-7-15(14)16)21-13-19(10-11-19)17-9-1-2-12-20-17/h1-2,4,6,8-9,12H,3,5,7,10-11,13H2,(H,21,22)
InChIKeyOKMWQXALLHSBNA-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.03
Rot. Bonds4

About N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide

N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide (PubChem CID 126807843) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide.

Molecular Properties

Compound NameN-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide
PubChem CID126807843
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC NameN-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide
SMILESO=C(NCC1(c2ccccn2)CC1)c1cccc2c1CCC2
InChIInChI=1S/C19H20N2O/c22-18(16-8-4-6-14-5-3-7-15(14)16)21-13-19(10-11-19)17-9-1-2-12-20-17/h1-2,4,6,8-9,12H,3,5,7,10-11,13H2,(H,21,22)
InChIKeyOKMWQXALLHSBNA-UHFFFAOYSA-N
XLogP3.03
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide?
The IUPAC name of N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide (CID 126807843) is N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide.
What is the SMILES notation for N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide?
The canonical SMILES for N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide is O=C(NCC1(c2ccccn2)CC1)c1cccc2c1CCC2.
What is the InChIKey of N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide?
The InChIKey is OKMWQXALLHSBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c22-18(16-8-4-6-14-5-3-7-15(14)16)21-13-19(10-11-19)17-9-1-2-12-20-17/h1-2,4,6,8-9,12H,3,5,7,10-11,13H2,(H,21,22).
What are the key properties of N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide?
N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-pyridin-2-ylcyclopropyl)methyl]-2,3-dihydro-1H-indene-4-carboxamide is sourced from PubChem (CID 126807843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).