2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

C14H26N6 — CID 80820823

IUPAC2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(N)nc(N(CC2CC2)C(C)C)n1
InChIInChI=1S/C14H26N6/c1-5-19(6-2)13-16-12(15)17-14(18-13)20(10(3)4)9-11-7-8-11/h10-11H,5-9H2,1-4H3,(H2,15,16,17,18)
InChIKeyZFDYLTMVRPSKKY-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.92
Rot. Bonds7

About 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80820823) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
PubChem CID80820823
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC Name2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCN(CC)c1nc(N)nc(N(CC2CC2)C(C)C)n1
InChIInChI=1S/C14H26N6/c1-5-19(6-2)13-16-12(15)17-14(18-13)20(10(3)4)9-11-7-8-11/h10-11H,5-9H2,1-4H3,(H2,15,16,17,18)
InChIKeyZFDYLTMVRPSKKY-UHFFFAOYSA-N
XLogP1.92
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine with MolForge

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Related Compounds

2-N-(cyclopropylmethyl)-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80839965
4-N-(cyclopropylmethyl)-4-N-propan-2-yl-6-(1,2,4-triazol-1-yl)-1,3,5-triazine-2,4-diamine
CID 80821216
2-[[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]-propan-2-ylamino]acetamide
CID 80805910
6-chloro-2-N-(cyclopropylmethyl)-2-N-ethyl-1,3,5-triazine-2,4-diamine
CID 80839478
2-N-cyclopropyl-4-N,4-N-diethyl-2-N-(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine
CID 80809874
2-N-cyclopropyl-2-N,4-N,4-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80773987
2-N-ethyl-4-N,4-N-dimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 80774603
4-N-(cyclopropylmethyl)-6-N-ethyl-4-N-propan-2-ylpyrimidine-2,4,6-triamine
CID 80820583
2-N-(cyclopropylmethyl)-4-N,4-N,6-N-trimethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
CID 80820992
2-N-(cyclobutylmethyl)-2-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 107403037
2-N-butan-2-yl-4-N,4-N-diethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4,6-triamine
CID 80787377
2-N,2-N,4-N-triethyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80774543

Frequently Asked Questions

What is the IUPAC name of 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (CID 80820823) is 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is CCN(CC)c1nc(N)nc(N(CC2CC2)C(C)C)n1.
What is the InChIKey of 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is ZFDYLTMVRPSKKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-5-19(6-2)13-16-12(15)17-14(18-13)20(10(3)4)9-11-7-8-11/h10-11H,5-9H2,1-4H3,(H2,15,16,17,18).
What are the key properties of 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 278.40 g/mol, XLogP of 1.92, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(cyclopropylmethyl)-4-N,4-N-diethyl-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80820823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).