1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine

C18H28N4 — CID 117211421

IUPAC1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine
SMILESNC1CCN(c2cnc(C3CCCCC3)nc2C2CC2)CC1
InChIInChI=1S/C18H28N4/c19-15-8-10-22(11-9-15)16-12-20-18(14-4-2-1-3-5-14)21-17(16)13-6-7-13/h12-15H,1-11,19H2
InChIKeyMYFZKVXUWYKPOP-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.33
Rot. Bonds3

About 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine

1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine (PubChem CID 117211421) has the molecular formula C18H28N4 and a molecular weight of 300.45 g/mol. Its IUPAC name is 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine
PubChem CID117211421
Molecular FormulaC18H28N4
Molecular Weight300.45 g/mol
Exact Mass300.23
IUPAC Name1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine
SMILESNC1CCN(c2cnc(C3CCCCC3)nc2C2CC2)CC1
InChIInChI=1S/C18H28N4/c19-15-8-10-22(11-9-15)16-12-20-18(14-4-2-1-3-5-14)21-17(16)13-6-7-13/h12-15H,1-11,19H2
InChIKeyMYFZKVXUWYKPOP-UHFFFAOYSA-N
XLogP3.33
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopentyl-2-cyclopropyl-5-piperazin-1-ylpyrimidine
CID 117211621
1-(4-cyclopentyl-2-propan-2-ylpyrimidin-5-yl)piperidin-4-amine
CID 117211579
1-(4-cyclopentyl-2-ethylpyrimidin-5-yl)piperidin-4-amine
CID 117211578
1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine
CID 117212011
1-(2-tert-butyl-4-cyclobutylpyrimidin-5-yl)piperidin-4-amine
CID 117211511
1-(2-cyclobutylpyrimidin-5-yl)piperidin-4-amine
CID 117212262
2-[5-(4-aminopiperidin-1-yl)-4-cyclopropylpyrimidin-2-yl]phenol
CID 136934519
3-[5-(4-aminopiperidin-1-yl)-2-cyclopropylpyrimidin-4-yl]phenol
CID 117211668
5-bromo-2-cyclopentyl-4-cyclopropylpyrimidine
CID 82374795
4-cyclohexyl-2-ethyl-5-piperazin-1-ylpyrimidine
CID 117211662
N'-(4-cyclopentyl-2-cyclopropylpyrimidin-5-yl)ethane-1,2-diamine
CID 117211581
N'-(2-cyclohexyl-4-cyclopentylpyrimidin-5-yl)propane-1,3-diamine
CID 117211607

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine?
The IUPAC name of 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine (CID 117211421) is 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine.
What is the SMILES notation for 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine?
The canonical SMILES for 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine is NC1CCN(c2cnc(C3CCCCC3)nc2C2CC2)CC1.
What is the InChIKey of 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine?
The InChIKey is MYFZKVXUWYKPOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4/c19-15-8-10-22(11-9-15)16-12-20-18(14-4-2-1-3-5-14)21-17(16)13-6-7-13/h12-15H,1-11,19H2.
What are the key properties of 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine?
1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine has a molecular weight of 300.45 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexyl-4-cyclopropylpyrimidin-5-yl)piperidin-4-amine is sourced from PubChem (CID 117211421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).