(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone

C14H21N5O — CID 66009185

IUPAC(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
SMILESNC1CCC(C(=O)N2CCN(c3cnccn3)CC2)C1
InChIInChI=1S/C14H21N5O/c15-12-2-1-11(9-12)14(20)19-7-5-18(6-8-19)13-10-16-3-4-17-13/h3-4,10-12H,1-2,5-9,15H2
InChIKeyAULBQDKCHSWERP-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.25
Rot. Bonds2

About (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone

(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone (PubChem CID 66009185) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
PubChem CID66009185
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
SMILESNC1CCC(C(=O)N2CCN(c3cnccn3)CC2)C1
InChIInChI=1S/C14H21N5O/c15-12-2-1-11(9-12)14(20)19-7-5-18(6-8-19)13-10-16-3-4-17-13/h3-4,10-12H,1-2,5-9,15H2
InChIKeyAULBQDKCHSWERP-UHFFFAOYSA-N
XLogP0.25
TPSA75.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(1S,3R,4R)-3-amino-4-hydroxycyclohexyl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 155510142
[(3R,6S)-6-amino-1-(oxan-4-yl)azepan-3-yl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 165417585
[(2S,4S)-2-methylpiperidin-4-yl]-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 120632592
(3-aminocyclopentyl)-[4-[4-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]methanone
CID 129171739
(3-aminocyclopentyl)-[4-(5-bromo-2-pyridinyl)piperazin-1-yl]methanone
CID 66009179
1-(cyclopropanecarbonyl)-4-pyrazin-2-yl-1,4-diazepane-6-carboxylic acid
CID 74244449
1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
CID 60715497
[4-(adamantane-1-carbonyl)piperazin-1-yl]-(1-pyrazin-2-ylpiperidin-4-yl)methanone
CID 78852026
ethyl (3S)-3-(4-pyrazin-2-ylpiperazine-1-carbonyl)piperidine-1-carboxylate
CID 32647962
morpholin-4-yl-(1-pyrazin-2-ylazetidin-3-yl)methanone
CID 163352710
[(1S,3S)-3-aminocyclopentyl]-pyrrolidin-1-ylmethanone
CID 97030843
[(1S,3R)-3-aminocyclopentyl]-[4-(2-chlorophenyl)piperazin-1-yl]methanone
CID 124523270

Frequently Asked Questions

What is the IUPAC name of (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone?
The IUPAC name of (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone (CID 66009185) is (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone.
What is the SMILES notation for (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone?
The canonical SMILES for (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone is NC1CCC(C(=O)N2CCN(c3cnccn3)CC2)C1.
What is the InChIKey of (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone?
The InChIKey is AULBQDKCHSWERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c15-12-2-1-11(9-12)14(20)19-7-5-18(6-8-19)13-10-16-3-4-17-13/h3-4,10-12H,1-2,5-9,15H2.
What are the key properties of (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone?
(3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone has a molecular weight of 275.36 g/mol, XLogP of 0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminocyclopentyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 66009185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).