3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine

C19H27N5 — CID 135100926

IUPAC3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NC1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C19H27N5/c1-23(2)19-18(20-11-12-21-19)22-17-9-14-24(15-10-17)13-8-16-6-4-3-5-7-16/h3-7,11-12,17H,8-10,13-15H2,1-2H3,(H,20,22)
InChIKeyYOTWGQLNNYTFQB-UHFFFAOYSA-N
MW325.46 g/mol
LogP2.66
Rot. Bonds6

About 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine

3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine (PubChem CID 135100926) has the molecular formula C19H27N5 and a molecular weight of 325.46 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine
PubChem CID135100926
Molecular FormulaC19H27N5
Molecular Weight325.46 g/mol
Exact Mass325.23
IUPAC Name3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine
SMILESCN(C)c1nccnc1NC1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C19H27N5/c1-23(2)19-18(20-11-12-21-19)22-17-9-14-24(15-10-17)13-8-16-6-4-3-5-7-16/h3-7,11-12,17H,8-10,13-15H2,1-2H3,(H,20,22)
InChIKeyYOTWGQLNNYTFQB-UHFFFAOYSA-N
XLogP2.66
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine 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

1,1-dimethyl-2-[1-(2-phenylethyl)pyrrolidin-3-yl]hydrazine
CID 83004992
1-(2-phenylethyl)-N-(1H-pyrazol-4-yl)piperidin-4-amine
CID 60797118
1-(2-phenylethyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidin-4-amine
CID 119165057
N,1-bis(2-phenylethyl)piperidin-4-amine
CID 24785666
N,N-dimethyl-2-[[1-(2-phenylethyl)piperidin-4-yl]amino]acetamide
CID 60796882
1-(2-phenylethyl)-N-pyrrol-1-ylpiperidin-4-amine
CID 13306762
N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine
CID 130165925
N'-methyl-N-[1-(2-phenylethyl)piperidin-4-yl]-N'-propan-2-ylethane-1,2-diamine
CID 119165252
N-ethenyl-1-(2-phenylethyl)piperidin-4-amine
CID 166738231
5-fluoro-4-methoxy-N-[1-(2-phenylethyl)piperidin-4-yl]pyrimidin-2-amine
CID 137342628
N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine
CID 119165181
N-[(R)-cyclopropyl-(1-methylimidazol-2-yl)methyl]-1-(2-phenylethyl)piperidin-4-amine
CID 124619726

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine?
The IUPAC name of 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine (CID 135100926) is 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine is CN(C)c1nccnc1NC1CCN(CCc2ccccc2)CC1.
What is the InChIKey of 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine?
The InChIKey is YOTWGQLNNYTFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5/c1-23(2)19-18(20-11-12-21-19)22-17-9-14-24(15-10-17)13-8-16-6-4-3-5-7-16/h3-7,11-12,17H,8-10,13-15H2,1-2H3,(H,20,22).
What are the key properties of 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine?
3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine has a molecular weight of 325.46 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrazine-2,3-diamine is sourced from PubChem (CID 135100926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).