N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide

C24H25N5O2 — CID 146209021

IUPACN-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide
SMILESCNCC(NC(=O)c1cc(-c2ccc3n[nH]c(C)c3c2)ccn1)c1cccc(OC)c1
InChIInChI=1S/C24H25N5O2/c1-15-20-12-16(7-8-21(20)29-28-15)17-9-10-26-22(13-17)24(30)27-23(14-25-2)18-5-4-6-19(11-18)31-3/h4-13,23,25H,14H2,1-3H3,(H,27,30)(H,28,29)
InChIKeyMSNCQZSMEDHJLV-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.63
Rot. Bonds7

About N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide

N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide (PubChem CID 146209021) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide
PubChem CID146209021
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC NameN-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide
SMILESCNCC(NC(=O)c1cc(-c2ccc3n[nH]c(C)c3c2)ccn1)c1cccc(OC)c1
InChIInChI=1S/C24H25N5O2/c1-15-20-12-16(7-8-21(20)29-28-15)17-9-10-26-22(13-17)24(30)27-23(14-25-2)18-5-4-6-19(11-18)31-3/h4-13,23,25H,14H2,1-3H3,(H,27,30)(H,28,29)
InChIKeyMSNCQZSMEDHJLV-UHFFFAOYSA-N
XLogP3.63
TPSA91.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-amino-1-(3-methoxyphenyl)ethyl]-2-(difluoromethoxy)-5-(3-methyl-2H-indazol-5-yl)benzamide
CID 146209069
N-[3-hydroxy-1-(3-methoxyphenyl)propyl]-4-(1H-indazol-5-yl)pyridine-2-carboxamide
CID 146208862
N-[(1R)-2-amino-1-(3-methoxyphenyl)ethyl]-3-(3-fluoro-2H-indazol-5-yl)benzamide
CID 146209142
N-[(1S)-2-[(4-bromobenzoyl)amino]-1-(3-methoxyphenyl)ethyl]-4-(3-methyl-1H-isoindol-5-yl)pyridine-2-carboxamide
CID 167592556
3-ethyl-N-[1-(3-methoxyphenyl)propyl]-2H-indazole-5-carboxamide
CID 123846554
4-amino-2-(3-methoxyphenyl)-N-(3-methyl-2H-indazol-5-yl)butanamide
CID 23570880
N-[1-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1-(3-methyl-2H-indazol-5-yl)cyclopropane-1-carboxamide
CID 66685314
N-[2-amino-1-(3-methylphenyl)ethyl]-6-(3-methyl-2H-indazol-5-yl)-2,3-dihydro-1H-isoindole-4-carboxamide
CID 163805680
4-methoxy-N-(1-pyridin-4-ylpropyl)pyridine-2-carboxamide
CID 91763496
4-(3-methoxyanilino)-N-(1-phenylethyl)pyridine-2-carboxamide
CID 109210708
2-(3-methoxyphenyl)-2-[4-oxo-6-(1H-pyrazol-4-yl)quinazolin-3-yl]acetic acid
CID 155594102
4-[2-(2-hydroxyethylamino)-4-pyridinyl]-N-[(1R)-1-(3-methoxyphenyl)ethyl]benzamide
CID 155518157

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide?
The IUPAC name of N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide (CID 146209021) is N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide?
The canonical SMILES for N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide is CNCC(NC(=O)c1cc(-c2ccc3n[nH]c(C)c3c2)ccn1)c1cccc(OC)c1.
What is the InChIKey of N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide?
The InChIKey is MSNCQZSMEDHJLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c1-15-20-12-16(7-8-21(20)29-28-15)17-9-10-26-22(13-17)24(30)27-23(14-25-2)18-5-4-6-19(11-18)31-3/h4-13,23,25H,14H2,1-3H3,(H,27,30)(H,28,29).
What are the key properties of N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide?
N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide has a molecular weight of 415.50 g/mol, XLogP of 3.63, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methoxyphenyl)-2-(methylamino)ethyl]-4-(3-methyl-2H-indazol-5-yl)pyridine-2-carboxamide is sourced from PubChem (CID 146209021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).