4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine

C11H22N4 — CID 152619293

IUPAC4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine
SMILESCCCC1=CC(CC)(NCC)N=C(N)N1
InChIInChI=1S/C11H22N4/c1-4-7-9-8-11(5-2,13-6-3)15-10(12)14-9/h8,13H,4-7H2,1-3H3,(H3,12,14,15)
InChIKeyZBEIYOTWBJQULU-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.30
Rot. Bonds5

About 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine

4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine (PubChem CID 152619293) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine
PubChem CID152619293
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine
SMILESCCCC1=CC(CC)(NCC)N=C(N)N1
InChIInChI=1S/C11H22N4/c1-4-7-9-8-11(5-2,13-6-3)15-10(12)14-9/h8,13H,4-7H2,1-3H3,(H3,12,14,15)
InChIKeyZBEIYOTWBJQULU-UHFFFAOYSA-N
XLogP1.30
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-aminoethyl)-5-fluoro-4-N,6-dimethyl-1H-pyrimidine-2,4-diamine
CID 153915437
N-butan-2-yl-N,5-dimethyl-6-[(Z)-3-(methylamino)prop-2-enyl]-1,4-dihydropyrimidin-4-amine
CID 118972846
6-Ethyl-1,4-dihydropyrimidine-2,4-diamine
CID 126732468
N'-[amino-[(3-methylcyclohexa-1,3-dien-1-yl)amino]methyl]pyrrolidine-1-carboximidamide
CID 144527446
N-methyl-1-[(3,4,6-trimethyl-1,4-dihydropyrimidin-2-ylidene)amino]methanamine
CID 146777793
Ethane;6-ethyl-1,4-dihydropyrimidine
CID 153622463
4-(2-aminoethyl)-4-N-methyl-6-propan-2-yl-1H-pyrimidine-2,4-diamine
CID 153915423
4-(2-aminoethyl)-6-tert-butyl-4-N-methyl-1H-pyrimidine-2,4-diamine
CID 153915428
4-(2-aminoethyl)-6-butyl-4-N-methyl-1H-pyrimidine-2,4-diamine
CID 153915429
1-(3-Amino-6-methylcyclohexa-2,4-dien-1-yl)-2-methylguanidine
CID 163464507
N'-[amino-[(3-methylcyclohexa-1,3-dien-1-yl)amino]methyl]pyrrolidine-1-carboximidamide
CID 163762524
2-(diethylamino)-6-propyl-1H-pyrimidine-4-thione
CID 106475190

Frequently Asked Questions

What is the IUPAC name of 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine?
The IUPAC name of 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine (CID 152619293) is 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine?
The canonical SMILES for 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine is CCCC1=CC(CC)(NCC)N=C(N)N1.
What is the InChIKey of 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine?
The InChIKey is ZBEIYOTWBJQULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-4-7-9-8-11(5-2,13-6-3)15-10(12)14-9/h8,13H,4-7H2,1-3H3,(H3,12,14,15).
What are the key properties of 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine?
4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine has a molecular weight of 210.32 g/mol, XLogP of 1.30, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-diethyl-6-propyl-1H-pyrimidine-2,4-diamine is sourced from PubChem (CID 152619293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).