4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine

C14H23N3 — CID 116893518

IUPAC4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine
SMILESCc1cc(C(C)C)nc(CC2CCCCN2)n1
InChIInChI=1S/C14H23N3/c1-10(2)13-8-11(3)16-14(17-13)9-12-6-4-5-7-15-12/h8,10,12,15H,4-7,9H2,1-3H3
InChIKeyPNZAEBKSRXMWEV-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.59
Rot. Bonds3

About 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine

4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine (PubChem CID 116893518) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine.

Molecular Properties

Compound Name4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine
PubChem CID116893518
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine
SMILESCc1cc(C(C)C)nc(CC2CCCCN2)n1
InChIInChI=1S/C14H23N3/c1-10(2)13-8-11(3)16-14(17-13)9-12-6-4-5-7-15-12/h8,10,12,15H,4-7,9H2,1-3H3
InChIKeyPNZAEBKSRXMWEV-UHFFFAOYSA-N
XLogP2.59
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-2-(piperidin-2-ylmethyl)-6-(1H-pyrrol-2-yl)pyrimidine
CID 116893520
N-(2-methoxyethyl)-4-methyl-6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyrimidin-2-amine
CID 106621007
N-[(4-chloro-6-methylpyrimidin-2-yl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106632134
4-tert-butyl-6-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 82666688
3-methyl-5-(piperidin-2-ylmethyl)-1,2-oxazole
CID 83846520
2-[(2-methyl-5-propan-2-ylphenyl)methyl]piperidine
CID 82495630
4,6-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71638393
5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231656
4-(piperidin-2-ylmethyl)-2-propan-2-yl-1,3-oxazole
CID 84734264
5-propan-2-yl-2-(pyrrolidin-2-ylmethyl)-1H-imidazole
CID 78969916
N-[(2,4-dichloro-6-methyl-3-pyridinyl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106632038
2-(4-methyl-6-propan-2-ylpyrimidin-2-yl)ethanol
CID 116893893

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine?
The IUPAC name of 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine (CID 116893518) is 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine.
What is the SMILES notation for 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine?
The canonical SMILES for 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine is Cc1cc(C(C)C)nc(CC2CCCCN2)n1.
What is the InChIKey of 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine?
The InChIKey is PNZAEBKSRXMWEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-10(2)13-8-11(3)16-14(17-13)9-12-6-4-5-7-15-12/h8,10,12,15H,4-7,9H2,1-3H3.
What are the key properties of 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine?
4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine has a molecular weight of 233.36 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(piperidin-2-ylmethyl)-6-propan-2-ylpyrimidine is sourced from PubChem (CID 116893518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).