6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine

C15H21N5 — CID 72857492

IUPAC6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine
SMILESCN(CCCc1cnn(C)c1)c1cc(C2CC2)ncn1
InChIInChI=1S/C15H21N5/c1-19(7-3-4-12-9-18-20(2)10-12)15-8-14(13-5-6-13)16-11-17-15/h8-11,13H,3-7H2,1-2H3
InChIKeyMPSCYEKBAADQJV-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.16
Rot. Bonds6

About 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine

6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine (PubChem CID 72857492) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine
PubChem CID72857492
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine
SMILESCN(CCCc1cnn(C)c1)c1cc(C2CC2)ncn1
InChIInChI=1S/C15H21N5/c1-19(7-3-4-12-9-18-20(2)10-12)15-8-14(13-5-6-13)16-11-17-15/h8-11,13H,3-7H2,1-2H3
InChIKeyMPSCYEKBAADQJV-UHFFFAOYSA-N
XLogP2.16
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine (CID 72857492) is 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine is CN(CCCc1cnn(C)c1)c1cc(C2CC2)ncn1.
What is the InChIKey of 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine?
The InChIKey is MPSCYEKBAADQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-19(7-3-4-12-9-18-20(2)10-12)15-8-14(13-5-6-13)16-11-17-15/h8-11,13H,3-7H2,1-2H3.
What are the key properties of 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine?
6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.16, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-methyl-N-[3-(1-methylpyrazol-4-yl)propyl]pyrimidin-4-amine is sourced from PubChem (CID 72857492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).