6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile

C10H14N4 — CID 130173843

IUPAC6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile
SMILESCCN(c1cc(C#N)ncn1)C(C)C
InChIInChI=1S/C10H14N4/c1-4-14(8(2)3)10-5-9(6-11)12-7-13-10/h5,7-8H,4H2,1-3H3
InChIKeyGEVLGROGHGEHAT-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.58
Rot. Bonds3

About 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile

6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile (PubChem CID 130173843) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile.

Molecular Properties

Compound Name6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile
PubChem CID130173843
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile
SMILESCCN(c1cc(C#N)ncn1)C(C)C
InChIInChI=1S/C10H14N4/c1-4-14(8(2)3)10-5-9(6-11)12-7-13-10/h5,7-8H,4H2,1-3H3
InChIKeyGEVLGROGHGEHAT-UHFFFAOYSA-N
XLogP1.58
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[1-hydroxypropan-2-yl(methyl)amino]pyrimidine-4-carbonitrile
CID 130173875
4-[ethyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 62924784
2-[ethyl(propan-2-yl)amino]-6-methylpyrimidine-4-carbonitrile
CID 107543609
6-[2-hydroxyethyl(methyl)amino]pyrimidine-4-carbonitrile
CID 130173820
6-[tert-butyl(methyl)amino]pyrimidine-4-carbonitrile
CID 115142786
4-[propan-2-yl(propyl)amino]pyridine-2-carbonitrile
CID 62927034
6-[methyl-[(4-methylphenyl)methyl]amino]pyrimidine-4-carbonitrile
CID 115142979
6-methylpyrimidine-4-carbonitrile
CID 12684335
6-[(4-methoxyphenyl)methyl-methylamino]pyrimidine-4-carbonitrile
CID 115142987
6-[(2,5-difluorophenyl)methyl-methylamino]pyrimidine-4-carbonitrile
CID 115143001
6-[methyl(1H-pyrrol-3-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 115143006
6-[(2-fluorophenyl)methyl-methylamino]pyrimidine-4-carbonitrile
CID 115143016

Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile?
The IUPAC name of 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile (CID 130173843) is 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile.
What is the SMILES notation for 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile?
The canonical SMILES for 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile is CCN(c1cc(C#N)ncn1)C(C)C.
What is the InChIKey of 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile?
The InChIKey is GEVLGROGHGEHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-4-14(8(2)3)10-5-9(6-11)12-7-13-10/h5,7-8H,4H2,1-3H3.
What are the key properties of 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile?
6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile has a molecular weight of 190.25 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(propan-2-yl)amino]pyrimidine-4-carbonitrile is sourced from PubChem (CID 130173843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).