4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine

C10H17ClN4O — CID 62858664

IUPAC4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine
SMILESCCCN(CCC)c1nc(Cl)nc(OC)n1
InChIInChI=1S/C10H17ClN4O/c1-4-6-15(7-5-2)9-12-8(11)13-10(14-9)16-3/h4-7H2,1-3H3
InChIKeyKTRIMWJUGFCWGY-UHFFFAOYSA-N
MW244.73 g/mol
LogP2.16
Rot. Bonds6

About 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine

4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine (PubChem CID 62858664) has the molecular formula C10H17ClN4O and a molecular weight of 244.73 g/mol. Its IUPAC name is 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine
PubChem CID62858664
Molecular FormulaC10H17ClN4O
Molecular Weight244.73 g/mol
Exact Mass244.11
IUPAC Name4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine
SMILESCCCN(CCC)c1nc(Cl)nc(OC)n1
InChIInChI=1S/C10H17ClN4O/c1-4-6-15(7-5-2)9-12-8(11)13-10(14-9)16-3/h4-7H2,1-3H3
InChIKeyKTRIMWJUGFCWGY-UHFFFAOYSA-N
XLogP2.16
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.73
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine (CID 62858664) is 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine is CCCN(CCC)c1nc(Cl)nc(OC)n1.
What is the InChIKey of 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine?
The InChIKey is KTRIMWJUGFCWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN4O/c1-4-6-15(7-5-2)9-12-8(11)13-10(14-9)16-3/h4-7H2,1-3H3.
What are the key properties of 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine?
4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine has a molecular weight of 244.73 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 4-chloro-6-methoxy-N,N-dipropyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 62858664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).