4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine

C19H23N7 — CID 72858908

IUPAC4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCCC(c3nccn3Cc3ccccn3)C2)nc(N)n1
InChIInChI=1S/C19H23N7/c1-14-11-17(24-19(20)23-14)25-9-4-5-15(12-25)18-22-8-10-26(18)13-16-6-2-3-7-21-16/h2-3,6-8,10-11,15H,4-5,9,12-13H2,1H3,(H2,20,23,24)
InChIKeyTXIZSBACDPVWNE-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.39
Rot. Bonds4

About 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine

4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine (PubChem CID 72858908) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine
PubChem CID72858908
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC Name4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCCC(c3nccn3Cc3ccccn3)C2)nc(N)n1
InChIInChI=1S/C19H23N7/c1-14-11-17(24-19(20)23-14)25-9-4-5-15(12-25)18-22-8-10-26(18)13-16-6-2-3-7-21-16/h2-3,6-8,10-11,15H,4-5,9,12-13H2,1H3,(H2,20,23,24)
InChIKeyTXIZSBACDPVWNE-UHFFFAOYSA-N
XLogP2.39
TPSA85.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-methyl-2-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 72859530
2-methyl-4-propyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 72906714
4-[(3R)-3-[1-(cyclopropylmethyl)imidazol-2-yl]piperidin-1-yl]-6-methylpyrimidin-2-amine
CID 96575726
6-[(3R)-3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97200300
2-[(3R)-3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 97202197
2-[(3S)-3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]quinoline
CID 97207632
4-methyl-6-[(3R)-3-(1-methylimidazol-2-yl)piperidin-1-yl]pyrimidin-2-amine
CID 96578525
4-[(3S)-3-(1-benzylimidazol-2-yl)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 96573599
4,5-dimethyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 72872204
5-ethyl-2-methyl-4-[(3S)-3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidine
CID 97141189
6-[(3R)-3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyridine-3-carboxylic acid
CID 97195658
5-[(3R)-1-(2-amino-6-methylpyrimidin-4-yl)piperidin-3-yl]-2-methyl-4-phenyl-1,2,4-triazol-3-one
CID 95214641

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine?
The IUPAC name of 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine (CID 72858908) is 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine is Cc1cc(N2CCCC(c3nccn3Cc3ccccn3)C2)nc(N)n1.
What is the InChIKey of 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine?
The InChIKey is TXIZSBACDPVWNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7/c1-14-11-17(24-19(20)23-14)25-9-4-5-15(12-25)18-22-8-10-26(18)13-16-6-2-3-7-21-16/h2-3,6-8,10-11,15H,4-5,9,12-13H2,1H3,(H2,20,23,24).
What are the key properties of 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine?
4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine has a molecular weight of 349.44 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[3-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 72858908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).