1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide

C11H18N6O — CID 80756026

IUPAC1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide
SMILESCNc1cc(N2CCCC(C(N)=O)C2)nc(N)n1
InChIInChI=1S/C11H18N6O/c1-14-8-5-9(16-11(13)15-8)17-4-2-3-7(6-17)10(12)18/h5,7H,2-4,6H2,1H3,(H2,12,18)(H3,13,14,15,16)
InChIKeyVPRUJFVNGYUGDY-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.20
Rot. Bonds3

About 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide

1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide (PubChem CID 80756026) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide
PubChem CID80756026
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide
SMILESCNc1cc(N2CCCC(C(N)=O)C2)nc(N)n1
InChIInChI=1S/C11H18N6O/c1-14-8-5-9(16-11(13)15-8)17-4-2-3-7(6-17)10(12)18/h5,7H,2-4,6H2,1H3,(H2,12,18)(H3,13,14,15,16)
InChIKeyVPRUJFVNGYUGDY-UHFFFAOYSA-N
XLogP-0.20
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[6-(methylamino)-2-(trifluoromethyl)pyrimidin-4-yl]piperidine-3-carboxamide
CID 106769882
(3R)-1-[2-amino-6-(cyclopropylamino)pyrimidin-4-yl]pyrrolidine-3-carboxamide
CID 122456347
(3R)-1-(2-amino-6-chloropyrimidin-4-yl)piperidine-3-carboxylic acid
CID 94830339
1-[2-amino-6-(methylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80806770
[(3R,4R)-1-[2-amino-6-(methylamino)pyrimidin-4-yl]-4-(azepan-1-ylmethyl)pyrrolidin-3-yl]methanol
CID 72925475
4-N-methyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)pyrimidine-2,4-diamine
CID 80848559
1-[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80957124
1-[4-(aminomethyl)-6-methyl-2-pyridinyl]piperidine-3-carboxamide
CID 114765128
1-(6-hydrazinyl-2-pyridinyl)piperidine-3-carboxamide
CID 80918435
N-[[1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidin-4-yl]methyl]acetamide
CID 102737062
(3R)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide
CID 7353330
1-(6-amino-2-methylsulfanylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103198582

Frequently Asked Questions

What is the IUPAC name of 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide?
The IUPAC name of 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide (CID 80756026) is 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide?
The canonical SMILES for 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide is CNc1cc(N2CCCC(C(N)=O)C2)nc(N)n1.
What is the InChIKey of 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide?
The InChIKey is VPRUJFVNGYUGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-14-8-5-9(16-11(13)15-8)17-4-2-3-7(6-17)10(12)18/h5,7H,2-4,6H2,1H3,(H2,12,18)(H3,13,14,15,16).
What are the key properties of 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide?
1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.20, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-amino-6-(methylamino)pyrimidin-4-yl]piperidine-3-carboxamide is sourced from PubChem (CID 80756026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).