6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine

C14H21N7 — CID 126887741

IUPAC6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine
SMILESCc1cc(NC2CCN(Cc3cnnn3C)CC2)ncn1
InChIInChI=1S/C14H21N7/c1-11-7-14(16-10-15-11)18-12-3-5-21(6-4-12)9-13-8-17-19-20(13)2/h7-8,10,12H,3-6,9H2,1-2H3,(H,15,16,18)
InChIKeyIMNFPMFGYQMEDQ-UHFFFAOYSA-N
MW287.37 g/mol
LogP0.99
Rot. Bonds4

About 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine

6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine (PubChem CID 126887741) has the molecular formula C14H21N7 and a molecular weight of 287.37 g/mol. Its IUPAC name is 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine
PubChem CID126887741
Molecular FormulaC14H21N7
Molecular Weight287.37 g/mol
Exact Mass287.19
IUPAC Name6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine
SMILESCc1cc(NC2CCN(Cc3cnnn3C)CC2)ncn1
InChIInChI=1S/C14H21N7/c1-11-7-14(16-10-15-11)18-12-3-5-21(6-4-12)9-13-8-17-19-20(13)2/h7-8,10,12H,3-6,9H2,1-2H3,(H,15,16,18)
InChIKeyIMNFPMFGYQMEDQ-UHFFFAOYSA-N
XLogP0.99
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine
CID 126887317
6-methyl-N-[1-[2-(2-methyl-1,3-oxazol-5-yl)ethyl]piperidin-4-yl]pyrimidin-4-amine
CID 126887752
N-[1-(cyclobutylmethyl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887813
6-methyl-N-[1-[(2-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)methyl]piperidin-4-yl]pyrimidin-4-amine
CID 126887894
N-cyclobutyl-6-methylpyrimidin-4-amine
CID 62416944
5-N-[(4S)-1-[(3-methyltriazol-4-yl)methyl]azepan-4-yl]pyridine-2,5-diamine
CID 129334899
N-[1-(6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-ylmethyl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887693
1-[2-[4-[(6-methylpyrimidin-4-yl)amino]piperidin-1-yl]ethyl]pyrimidin-2-one
CID 126887717
6-methyl-N-[1-(pyrazin-2-ylmethyl)pyrrolidin-3-yl]pyrimidin-4-amine
CID 171996018
6-methyl-N-[1-(5-methyl-1,3-thiazol-2-yl)piperidin-4-yl]pyrimidin-4-amine
CID 165432269
N-[1-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-2-ylmethyl)piperidin-4-yl]-6-methylpyrimidin-4-amine
CID 126887700
N-(1,2-dimethylpiperidin-4-yl)-6-methylpyrimidin-4-amine
CID 79033350

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine (CID 126887741) is 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine is Cc1cc(NC2CCN(Cc3cnnn3C)CC2)ncn1.
What is the InChIKey of 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine?
The InChIKey is IMNFPMFGYQMEDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N7/c1-11-7-14(16-10-15-11)18-12-3-5-21(6-4-12)9-13-8-17-19-20(13)2/h7-8,10,12H,3-6,9H2,1-2H3,(H,15,16,18).
What are the key properties of 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine?
6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine has a molecular weight of 287.37 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[1-[(3-methyltriazol-4-yl)methyl]piperidin-4-yl]pyrimidin-4-amine is sourced from PubChem (CID 126887741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).