1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide

C15H23N5O — CID 80956690

IUPAC1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
SMILESCCNc1cc(N2CCC(C(N)=O)CC2)nc(C2CC2)n1
InChIInChI=1S/C15H23N5O/c1-2-17-12-9-13(19-15(18-12)11-3-4-11)20-7-5-10(6-8-20)14(16)21/h9-11H,2-8H2,1H3,(H2,16,21)(H,17,18,19)
InChIKeyMPDSXLCCVFJZIJ-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.49
Rot. Bonds5

About 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide

1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide (PubChem CID 80956690) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
PubChem CID80956690
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
SMILESCCNc1cc(N2CCC(C(N)=O)CC2)nc(C2CC2)n1
InChIInChI=1S/C15H23N5O/c1-2-17-12-9-13(19-15(18-12)11-3-4-11)20-7-5-10(6-8-20)14(16)21/h9-11H,2-8H2,1H3,(H2,16,21)(H,17,18,19)
InChIKeyMPDSXLCCVFJZIJ-UHFFFAOYSA-N
XLogP1.49
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80957124
1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide
CID 80917008
[1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
CID 80967620
2-cyclopropyl-N-ethyl-6-(2-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80967631
1-[2-amino-6-(ethylamino)pyrimidin-4-yl]piperidine-2-carboxamide
CID 80806613
2-[1-[6-(ethylamino)-2-methylsulfanylpyrimidin-4-yl]piperidin-4-yl]acetamide
CID 80785670
2-[[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]amino]-N-ethylacetamide
CID 80966811
1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidine-4-carboxamide
CID 137008934
2-[[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80967066
cyclopropyl-[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]piperazin-1-yl]methanone
CID 122351619
2-cyclopropyl-6-(3,5-diethylpyrazol-1-yl)-N-ethylpyrimidin-4-amine
CID 82698934
2-cyclopropyl-6-morpholin-4-yl-N-propylpyrimidin-4-amine
CID 80955847

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide (CID 80956690) is 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide is CCNc1cc(N2CCC(C(N)=O)CC2)nc(C2CC2)n1.
What is the InChIKey of 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide?
The InChIKey is MPDSXLCCVFJZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-2-17-12-9-13(19-15(18-12)11-3-4-11)20-7-5-10(6-8-20)14(16)21/h9-11H,2-8H2,1H3,(H2,16,21)(H,17,18,19).
What are the key properties of 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide?
1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide is sourced from PubChem (CID 80956690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).