ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate

C15H24N4O2 — CID 11500270

IUPACethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate
SMILESCCOC(=O)Nc1ccc(N2CCN(C(C)C)CC2)nc1
InChIInChI=1S/C15H24N4O2/c1-4-21-15(20)17-13-5-6-14(16-11-13)19-9-7-18(8-10-19)12(2)3/h5-6,11-12H,4,7-10H2,1-3H3,(H,17,20)
InChIKeyRZWVNDLSEBEXEN-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.18
Rot. Bonds4

About ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate

ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate (PubChem CID 11500270) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate.

Molecular Properties

Compound Nameethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate
PubChem CID11500270
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Nameethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate
SMILESCCOC(=O)Nc1ccc(N2CCN(C(C)C)CC2)nc1
InChIInChI=1S/C15H24N4O2/c1-4-21-15(20)17-13-5-6-14(16-11-13)19-9-7-18(8-10-19)12(2)3/h5-6,11-12H,4,7-10H2,1-3H3,(H,17,20)
InChIKeyRZWVNDLSEBEXEN-UHFFFAOYSA-N
XLogP2.18
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methylpropyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate
CID 11537062
ethyl N-(6-piperidin-1-yl-3-pyridinyl)carbamate
CID 60715583
ethyl N-[6-[4-(2-fluorophenyl)piperazin-1-yl]-3-pyridinyl]carbamate
CID 113014423
ethyl 4-[5-(3-methylbutanoylamino)-2-pyridinyl]piperazine-1-carboxylate
CID 113014216
ethyl N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]carbamate
CID 113015658
2-(3,4-dimethoxyphenyl)-N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]acetamide
CID 11718243
1-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]propan-1-one
CID 102546833
N-propan-2-yl-6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboxamide
CID 901299
ethyl N-[4-[(6-pyrrolidin-1-yl-3-pyridinyl)methylcarbamoyl]phenyl]carbamate
CID 37481999
ethyl N-[6-(propan-2-ylamino)-3-pyridinyl]carbamate
CID 115268615
3-amino-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]butanamide
CID 120872707
4-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)pentanamide;dihydrochloride
CID 120564420

Frequently Asked Questions

What is the IUPAC name of ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate?
The IUPAC name of ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate (CID 11500270) is ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate.
What is the SMILES notation for ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate?
The canonical SMILES for ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate is CCOC(=O)Nc1ccc(N2CCN(C(C)C)CC2)nc1.
What is the InChIKey of ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate?
The InChIKey is RZWVNDLSEBEXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-21-15(20)17-13-5-6-14(16-11-13)19-9-7-18(8-10-19)12(2)3/h5-6,11-12H,4,7-10H2,1-3H3,(H,17,20).
What are the key properties of ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate?
ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate has a molecular weight of 292.38 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]carbamate is sourced from PubChem (CID 11500270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).