4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide

C14H19N3O — CID 114096808

IUPAC4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)NCC2(C3CC3)CC2)cn1
InChIInChI=1S/C14H19N3O/c1-9-6-12(15)11(7-16-9)13(18)17-8-14(4-5-14)10-2-3-10/h6-7,10H,2-5,8H2,1H3,(H2,15,16)(H,17,18)
InChIKeyFCSWZRADHKOLEX-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.89
Rot. Bonds4

About 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide

4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide (PubChem CID 114096808) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide
PubChem CID114096808
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)NCC2(C3CC3)CC2)cn1
InChIInChI=1S/C14H19N3O/c1-9-6-12(15)11(7-16-9)13(18)17-8-14(4-5-14)10-2-3-10/h6-7,10H,2-5,8H2,1H3,(H2,15,16)(H,17,18)
InChIKeyFCSWZRADHKOLEX-UHFFFAOYSA-N
XLogP1.89
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[(1-ethylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide
CID 114101892
4-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]-6-methylpyridine-3-carboxamide
CID 83115454
4-amino-N-(2-cyclopentylethyl)-6-methylpyridine-3-carboxamide
CID 81243330
4-amino-6-methyl-N-[(2-methylthiolan-2-yl)methyl]pyridine-3-carboxamide
CID 81245860
4-amino-6-methyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81236449
4-amino-N,6-dimethylpyridine-3-carboxamide
CID 81236701
4-amino-6-methyl-N-(2-methylbutyl)pyridine-3-carboxamide
CID 81240046
4-amino-6-methyl-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 81243278
4-amino-6-methyl-N-[2-(methylsulfamoyl)ethyl]pyridine-3-carboxamide
CID 106342544
4-amino-6-methyl-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
CID 82736650
4-amino-6-methyl-N-phenylpyridine-3-carboxamide
CID 81236063
4-amino-6-methyl-N-(4-methyloxan-4-yl)pyridine-3-carboxamide
CID 113491311

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide (CID 114096808) is 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide is Cc1cc(N)c(C(=O)NCC2(C3CC3)CC2)cn1.
What is the InChIKey of 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide?
The InChIKey is FCSWZRADHKOLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-9-6-12(15)11(7-16-9)13(18)17-8-14(4-5-14)10-2-3-10/h6-7,10H,2-5,8H2,1H3,(H2,15,16)(H,17,18).
What are the key properties of 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide?
4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide has a molecular weight of 245.33 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(1-cyclopropylcyclopropyl)methyl]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 114096808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).