tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate

C16H19N3O2 — CID 66606109

IUPACtert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate
SMILESCC(C)(C)OC(=O)NC1(c2ccc3ncccc3n2)CC1
InChIInChI=1S/C16H19N3O2/c1-15(2,3)21-14(20)19-16(8-9-16)13-7-6-11-12(18-13)5-4-10-17-11/h4-7,10H,8-9H2,1-3H3,(H,19,20)
InChIKeyAKLZOBYOAAVMFH-UHFFFAOYSA-N
MW285.35 g/mol
LogP3.14
Rot. Bonds2

About tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate

tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate (PubChem CID 66606109) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate
PubChem CID66606109
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Nametert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate
SMILESCC(C)(C)OC(=O)NC1(c2ccc3ncccc3n2)CC1
InChIInChI=1S/C16H19N3O2/c1-15(2,3)21-14(20)19-16(8-9-16)13-7-6-11-12(18-13)5-4-10-17-11/h4-7,10H,8-9H2,1-3H3,(H,19,20)
InChIKeyAKLZOBYOAAVMFH-UHFFFAOYSA-N
XLogP3.14
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[1-(5-phenyl-2-pyridinyl)cyclopropyl]carbamate
CID 141105169
tert-butyl N-[1-(2-formyl-1H-pyrrolo[2,3-b]pyridin-6-yl)cyclopropyl]carbamate
CID 167290510
[5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropyl]quinolin-7-yl] trifluoromethanesulfonate
CID 171792185
3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropyl]benzoic acid
CID 172639068
tert-butyl N-(quinoline-6-carbonylamino)carbamate
CID 155213246
5-[(2-methylpropan-2-yl)oxycarbonylamino]-6,7-dihydrocyclopenta[b]pyridine-5-carboxylic acid
CID 138110706
tert-butyl N-[1-(4-bromophenyl)cyclopropyl]carbamate
CID 53216208
tert-butyl N-[1-(4-chloro-3-pyridinyl)cyclopropyl]carbamate
CID 129242449
tert-butyl N-[1-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]cyclopropyl]carbamate
CID 67516007
tert-butyl 3-(methoxycarbonylamino)-3-pyridin-2-ylpyrrolidine-1-carboxylate
CID 22236948
tert-butyl N-[(3R)-3-(6-chloropyridazin-3-yl)pyrrolidin-3-yl]carbamate
CID 118542732
tert-butyl N-[3-(4-chloro-2-pyridinyl)oxetan-3-yl]carbamate
CID 166161006

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate?
The IUPAC name of tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate (CID 66606109) is tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate.
What is the SMILES notation for tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate?
The canonical SMILES for tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate is CC(C)(C)OC(=O)NC1(c2ccc3ncccc3n2)CC1.
What is the InChIKey of tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate?
The InChIKey is AKLZOBYOAAVMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-15(2,3)21-14(20)19-16(8-9-16)13-7-6-11-12(18-13)5-4-10-17-11/h4-7,10H,8-9H2,1-3H3,(H,19,20).
What are the key properties of tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate?
tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate has a molecular weight of 285.35 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[1-(1,5-naphthyridin-2-yl)cyclopropyl]carbamate is sourced from PubChem (CID 66606109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).