tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate

C14H26N2O3 — CID 107237603

IUPACtert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate
SMILESCC(C)(C)OC(=O)NC1CC1NC1CC(O)C1(C)C
InChIInChI=1S/C14H26N2O3/c1-13(2,3)19-12(18)16-9-6-8(9)15-10-7-11(17)14(10,4)5/h8-11,15,17H,6-7H2,1-5H3,(H,16,18)
InChIKeyOJMGRLSPTMRRHN-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.40
Rot. Bonds3

About tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate

tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate (PubChem CID 107237603) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate
PubChem CID107237603
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Nametert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate
SMILESCC(C)(C)OC(=O)NC1CC1NC1CC(O)C1(C)C
InChIInChI=1S/C14H26N2O3/c1-13(2,3)19-12(18)16-9-6-8(9)15-10-7-11(17)14(10,4)5/h8-11,15,17H,6-7H2,1-5H3,(H,16,18)
InChIKeyOJMGRLSPTMRRHN-UHFFFAOYSA-N
XLogP1.40
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate with MolForge

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Related Compounds

tert-butyl N-[2-[(4,4-dimethylthian-3-yl)amino]cyclopropyl]carbamate
CID 107237709
tert-butyl N-[2-[(3,3,5-trimethylcyclohexyl)amino]cyclopropyl]carbamate
CID 107237944
tert-butyl N-[2-[(3-methoxycyclobutyl)amino]cyclopropyl]carbamate
CID 107238333
tert-butyl N-[(1R,2R)-2-methylcyclopropyl]carbamate
CID 121309332
tert-butyl N-[3-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propyl]carbamate
CID 115976671
tert-butyl N-[2-[(8,8-dimethyl-2-oxabicyclo[4.2.0]octan-7-yl)amino]cyclopropyl]carbamate
CID 107237597
tert-butyl N-[2-[(5,5-dimethylthian-3-yl)amino]cyclopropyl]carbamate
CID 107238022
tert-butyl N-[(3S)-7,7-dichloro-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-bicyclo[4.1.0]heptanyl]carbamate
CID 134438268
tert-butyl N-[2-[(1,2,5-trimethylpiperidin-4-yl)amino]cyclopropyl]carbamate
CID 107237764
tert-butyl N-[2-[(5-methylthiolan-3-yl)amino]cyclopropyl]carbamate
CID 107237589
tert-butyl N-[(2S)-spiro[2.4]heptan-2-yl]carbamate
CID 98042480
tert-butyl N-(2,2-dimethylcyclopropyl)carbamate
CID 65142866

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate?
The IUPAC name of tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate (CID 107237603) is tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate?
The canonical SMILES for tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate is CC(C)(C)OC(=O)NC1CC1NC1CC(O)C1(C)C.
What is the InChIKey of tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate?
The InChIKey is OJMGRLSPTMRRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-13(2,3)19-12(18)16-9-6-8(9)15-10-7-11(17)14(10,4)5/h8-11,15,17H,6-7H2,1-5H3,(H,16,18).
What are the key properties of tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate?
tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate has a molecular weight of 270.37 g/mol, XLogP of 1.40, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]cyclopropyl]carbamate is sourced from PubChem (CID 107237603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).