N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide

C19H25N5O2 — CID 154801380

IUPACN-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide
SMILESCOCC(NC(=O)N1CCN(c2nccnc2C)CC1)c1ccccc1
InChIInChI=1S/C19H25N5O2/c1-15-18(21-9-8-20-15)23-10-12-24(13-11-23)19(25)22-17(14-26-2)16-6-4-3-5-7-16/h3-9,17H,10-14H2,1-2H3,(H,22,25)
InChIKeyMQFVXBWYAGFIPD-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.00
Rot. Bonds5

About N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide

N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide (PubChem CID 154801380) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide
PubChem CID154801380
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC NameN-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide
SMILESCOCC(NC(=O)N1CCN(c2nccnc2C)CC1)c1ccccc1
InChIInChI=1S/C19H25N5O2/c1-15-18(21-9-8-20-15)23-10-12-24(13-11-23)19(25)22-17(14-26-2)16-6-4-3-5-7-16/h3-9,17H,10-14H2,1-2H3,(H,22,25)
InChIKeyMQFVXBWYAGFIPD-UHFFFAOYSA-N
XLogP2.00
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-methoxy-1-phenylethyl)carbamic acid
CID 69063915
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CID 78857188
N-benzhydryl-4-(3-chloro-2-pyridinyl)piperazine-1-carboxamide
CID 21037675
N-[(1R)-1-(4-ethoxyphenyl)-2-methoxyethyl]-7,8-dihydro-5H-pyrido[3,4-b]pyrazine-6-carboxamide
CID 167894520
ethyl (3R)-3-[[4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)piperazine-1-carbonyl]amino]-3-phenylpropanoate
CID 95053127
N-(1,2-diphenylethyl)-4-(2-methoxyacetyl)piperazine-1-carboxamide
CID 87000159
ethyl (3S)-3-phenyl-3-[[4-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperazine-1-carbonyl]amino]propanoate
CID 95073065
N-(1-phenylethyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108988786
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]thiomorpholine-4-carboxamide
CID 124847644
(3aS,6aR)-2-[(2-methoxy-1-phenylethyl)carbamoyl]-1,3,4,5,6,6a-hexahydrocyclopenta[c]pyrrole-3a-carboxylic acid
CID 122000272
4-(5-chloro-2-pyridinyl)-N-[(1S)-2-methoxy-1-(2-methylpyrazol-3-yl)ethyl]piperazine-1-carboxamide
CID 125438765
N-(4-phenylbutan-2-yl)-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 47015071

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide?
The IUPAC name of N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide (CID 154801380) is N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide?
The canonical SMILES for N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide is COCC(NC(=O)N1CCN(c2nccnc2C)CC1)c1ccccc1.
What is the InChIKey of N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide?
The InChIKey is MQFVXBWYAGFIPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-15-18(21-9-8-20-15)23-10-12-24(13-11-23)19(25)22-17(14-26-2)16-6-4-3-5-7-16/h3-9,17H,10-14H2,1-2H3,(H,22,25).
What are the key properties of N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide?
N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-1-phenylethyl)-4-(3-methylpyrazin-2-yl)piperazine-1-carboxamide is sourced from PubChem (CID 154801380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).