tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate

C14H22N4O2 — CID 107237510

IUPACtert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate
SMILESCC(NC1CC1NC(=O)OC(C)(C)C)c1cnccn1
InChIInChI=1S/C14H22N4O2/c1-9(12-8-15-5-6-16-12)17-10-7-11(10)18-13(19)20-14(2,3)4/h5-6,8-11,17H,7H2,1-4H3,(H,18,19)
InChIKeyZYFKAQSHLLRBHC-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.79
Rot. Bonds4

About tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate

tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate (PubChem CID 107237510) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate
PubChem CID107237510
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Nametert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate
SMILESCC(NC1CC1NC(=O)OC(C)(C)C)c1cnccn1
InChIInChI=1S/C14H22N4O2/c1-9(12-8-15-5-6-16-12)17-10-7-11(10)18-13(19)20-14(2,3)4/h5-6,8-11,17H,7H2,1-4H3,(H,18,19)
InChIKeyZYFKAQSHLLRBHC-UHFFFAOYSA-N
XLogP1.79
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl N-[2-[1-(1H-pyrazol-5-yl)ethylamino]cyclopropyl]carbamate
CID 107237572
tert-butyl 4-[[(1S)-1-pyrazin-2-ylethyl]amino]piperidine-1-carboxylate
CID 97175693
tert-butyl (3S)-3-[[(1S)-1-pyrazin-2-ylethyl]amino]pyrrolidine-1-carboxylate
CID 97175478
tert-butyl N-[(3R)-1-[(1S)-1-pyrazin-2-ylethyl]pyrrolidin-3-yl]carbamate
CID 97175522
tert-butyl N-[2-[1-(2-chlorophenyl)ethylamino]cyclopropyl]carbamate
CID 107238238
tert-butyl N-[2-[1-(2,4,6-trimethyl-3-pyridinyl)ethylamino]cyclopropyl]carbamate
CID 107238280
tert-butyl N-[2-[1-(2,4-dihydroxyphenyl)ethylamino]cyclopropyl]carbamate
CID 107237842
tert-butyl N-[2-[1-(4-hydroxy-3-methoxyphenyl)ethylamino]cyclopropyl]carbamate
CID 107238193
tert-butyl N-[2-(1-pyridin-3-ylethylamino)cyclopentyl]carbamate
CID 107243829
tert-butyl N-[2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]cyclopropyl]carbamate
CID 107237507
tert-butyl N-[2-(4-methylpentan-2-ylamino)cyclopropyl]carbamate
CID 107238063
tert-butyl N-[2-(1-methoxypropan-2-ylamino)cyclopropyl]carbamate
CID 107237881

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate?
The IUPAC name of tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate (CID 107237510) is tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate?
The canonical SMILES for tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate is CC(NC1CC1NC(=O)OC(C)(C)C)c1cnccn1.
What is the InChIKey of tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate?
The InChIKey is ZYFKAQSHLLRBHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-9(12-8-15-5-6-16-12)17-10-7-11(10)18-13(19)20-14(2,3)4/h5-6,8-11,17H,7H2,1-4H3,(H,18,19).
What are the key properties of tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate?
tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate has a molecular weight of 278.36 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-(1-pyrazin-2-ylethylamino)cyclopropyl]carbamate is sourced from PubChem (CID 107237510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).