N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine

C11H18N4 — CID 78945406

IUPACN-ethyl-1-pyrimidin-4-ylpiperidin-3-amine
SMILESCCNC1CCCN(c2ccncn2)C1
InChIInChI=1S/C11H18N4/c1-2-13-10-4-3-7-15(8-10)11-5-6-12-9-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyNYNCUJNYIVYBLZ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.05
Rot. Bonds3

About N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine

N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine (PubChem CID 78945406) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine.

Molecular Properties

Compound NameN-ethyl-1-pyrimidin-4-ylpiperidin-3-amine
PubChem CID78945406
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-ethyl-1-pyrimidin-4-ylpiperidin-3-amine
SMILESCCNC1CCCN(c2ccncn2)C1
InChIInChI=1S/C11H18N4/c1-2-13-10-4-3-7-15(8-10)11-5-6-12-9-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyNYNCUJNYIVYBLZ-UHFFFAOYSA-N
XLogP1.05
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine 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

4-(3-tert-butylpiperidin-1-yl)pyrimidine
CID 58394793
ethane;propane;4-pyrrolidin-1-ylpyrimidine
CID 156866865
4-[(3S)-3-ethylpyrrolidin-1-yl]pyrimidine
CID 163491311
2-methyl-2-(1-pyrimidin-4-ylpiperidin-3-yl)propanoic acid
CID 83197349
N-ethyl-1-(5-methylpyridazin-3-yl)piperidin-3-amine
CID 106549225
(1-pyrimidin-4-ylpyrrolidin-3-yl)carbamic acid
CID 66765635
(3R)-N-ethyl-1-(3-pyrimidin-5-yl-1H-pyrrolo[2,3-b]pyridin-4-yl)piperidin-3-amine
CID 165156760
N-methyl-1-(1-pyrimidin-4-ylpiperidin-4-yl)ethanamine
CID 63854224
4-methyl-1-pyrimidin-4-ylpyrrolidin-3-ol
CID 130949550
1-(2-chloro-6-methylphenyl)-N-ethylpiperidin-3-amine
CID 66251825
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62545846
4-[(3R)-3-[(4-methylsulfonyl-1H-pyrazol-5-yl)methyl]piperidin-1-yl]pyrimidine
CID 125021083

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine?
The IUPAC name of N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine (CID 78945406) is N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine.
What is the SMILES notation for N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine?
The canonical SMILES for N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine is CCNC1CCCN(c2ccncn2)C1.
What is the InChIKey of N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine?
The InChIKey is NYNCUJNYIVYBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-2-13-10-4-3-7-15(8-10)11-5-6-12-9-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3.
What are the key properties of N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine?
N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-pyrimidin-4-ylpiperidin-3-amine is sourced from PubChem (CID 78945406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).