N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine

C15H23N3 — CID 133460864

IUPACN,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine
SMILESCCc1cc(N(CC2CC2)CC2CC2)nc(C)n1
InChIInChI=1S/C15H23N3/c1-3-14-8-15(17-11(2)16-14)18(9-12-4-5-12)10-13-6-7-13/h8,12-13H,3-7,9-10H2,1-2H3
InChIKeyYUGKVNLVAFJRBV-UHFFFAOYSA-N
MW245.37 g/mol
LogP2.97
Rot. Bonds6

About N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine

N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine (PubChem CID 133460864) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine
PubChem CID133460864
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine
SMILESCCc1cc(N(CC2CC2)CC2CC2)nc(C)n1
InChIInChI=1S/C15H23N3/c1-3-14-8-15(17-11(2)16-14)18(9-12-4-5-12)10-13-6-7-13/h8,12-13H,3-7,9-10H2,1-2H3
InChIKeyYUGKVNLVAFJRBV-UHFFFAOYSA-N
XLogP2.97
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine?
The IUPAC name of N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine (CID 133460864) is N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine.
What is the SMILES notation for N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine?
The canonical SMILES for N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine is CCc1cc(N(CC2CC2)CC2CC2)nc(C)n1.
What is the InChIKey of N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine?
The InChIKey is YUGKVNLVAFJRBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-3-14-8-15(17-11(2)16-14)18(9-12-4-5-12)10-13-6-7-13/h8,12-13H,3-7,9-10H2,1-2H3.
What are the key properties of N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine?
N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine has a molecular weight of 245.37 g/mol, XLogP of 2.97, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(cyclopropylmethyl)-6-ethyl-2-methylpyrimidin-4-amine is sourced from PubChem (CID 133460864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).