2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine

C15H18N4 — CID 171691345

IUPAC2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(N(C)Cc2ccncc2)nc(C2CC2)n1
InChIInChI=1S/C15H18N4/c1-11-9-14(18-15(17-11)13-3-4-13)19(2)10-12-5-7-16-8-6-12/h5-9,13H,3-4,10H2,1-2H3
InChIKeyLJIZPTYLSBNRAT-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.69
Rot. Bonds4

About 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine

2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine (PubChem CID 171691345) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
PubChem CID171691345
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(N(C)Cc2ccncc2)nc(C2CC2)n1
InChIInChI=1S/C15H18N4/c1-11-9-14(18-15(17-11)13-3-4-13)19(2)10-12-5-7-16-8-6-12/h5-9,13H,3-4,10H2,1-2H3
InChIKeyLJIZPTYLSBNRAT-UHFFFAOYSA-N
XLogP2.69
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine (CID 171691345) is 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine is Cc1cc(N(C)Cc2ccncc2)nc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
The InChIKey is LJIZPTYLSBNRAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-11-9-14(18-15(17-11)13-3-4-13)19(2)10-12-5-7-16-8-6-12/h5-9,13H,3-4,10H2,1-2H3.
What are the key properties of 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine?
2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine has a molecular weight of 254.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 171691345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).