5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide

C13H21N5O — CID 114090484

IUPAC5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide
SMILESCC1CN(c2cc(C(N)=O)c(N)cn2)CC1N(C)C
InChIInChI=1S/C13H21N5O/c1-8-6-18(7-11(8)17(2)3)12-4-9(13(15)19)10(14)5-16-12/h4-5,8,11H,6-7,14H2,1-3H3,(H2,15,19)
InChIKeyPOFJOIGEUVLGAU-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.15
Rot. Bonds3

About 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide

5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide (PubChem CID 114090484) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide
PubChem CID114090484
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide
SMILESCC1CN(c2cc(C(N)=O)c(N)cn2)CC1N(C)C
InChIInChI=1S/C13H21N5O/c1-8-6-18(7-11(8)17(2)3)12-4-9(13(15)19)10(14)5-16-12/h4-5,8,11H,6-7,14H2,1-3H3,(H2,15,19)
InChIKeyPOFJOIGEUVLGAU-UHFFFAOYSA-N
XLogP0.15
TPSA88.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyrimidin-4-amine
CID 81470283
5-amino-2-(3-azabicyclo[3.3.1]nonan-3-yl)pyridine-4-carboxamide
CID 114196713
3-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]benzamide
CID 112579335
5-amino-2-(4-propylpiperidin-1-yl)pyridine-4-carboxamide
CID 114090312
5-amino-2-(4-propylpiperazin-1-yl)pyridine-4-carboxamide
CID 114090039
1-(6-fluoropyrimidin-4-yl)-N,N,4-trimethylpyrrolidin-3-amine
CID 115417231
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-methylsulfanylpyrimidin-4-amine
CID 81469287
methyl 5-amino-2-(3-hydroxy-4-methylpiperidin-1-yl)pyridine-4-carboxylate
CID 114090703
N,N,4-trimethyl-1-(5-methylpyrimidin-2-yl)pyrrolidin-3-amine
CID 133404241
tert-butyl 4-(5-amino-4-carbamoyl-2-pyridinyl)-3-methylpiperazine-1-carboxylate
CID 175925127
5-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyrazine-2-carbonitrile
CID 81463984
2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboximidamide
CID 81464752

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The IUPAC name of 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide (CID 114090484) is 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide is CC1CN(c2cc(C(N)=O)c(N)cn2)CC1N(C)C.
What is the InChIKey of 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
The InChIKey is POFJOIGEUVLGAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-8-6-18(7-11(8)17(2)3)12-4-9(13(15)19)10(14)5-16-12/h4-5,8,11H,6-7,14H2,1-3H3,(H2,15,19).
What are the key properties of 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide?
5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 114090484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).