methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane

C8H21N3O3 — CID 144526153

IUPACmethanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane
SMILESCCC.CN.COC(=O)NCC(N)=O
InChIInChI=1S/C4H8N2O3.C3H8.CH5N/c1-9-4(8)6-2-3(5)7;1-3-2;1-2/h2H2,1H3,(H2,5,7)(H,6,8);3H2,1-2H3;2H2,1H3
InChIKeyMZHAMIPJXCLERR-UHFFFAOYSA-N
MW207.27 g/mol
LogP-0.18
Rot. Bonds2

About methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane

methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane (PubChem CID 144526153) has the molecular formula C8H21N3O3 and a molecular weight of 207.27 g/mol. Its IUPAC name is methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane.

Molecular Properties

Compound Namemethanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane
PubChem CID144526153
Molecular FormulaC8H21N3O3
Molecular Weight207.27 g/mol
Exact Mass207.16
IUPAC Namemethanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane
SMILESCCC.CN.COC(=O)NCC(N)=O
InChIInChI=1S/C4H8N2O3.C3H8.CH5N/c1-9-4(8)6-2-3(5)7;1-3-2;1-2/h2H2,1H3,(H2,5,7)(H,6,8);3H2,1-2H3;2H2,1H3
InChIKeyMZHAMIPJXCLERR-UHFFFAOYSA-N
XLogP-0.18
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(methoxycarbonylamino)acetate
CID 14133519
methyl N-(2-aminoethyl)carbamate;propane
CID 160898455
tert-butyl N-[2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl]carbamate
CID 14236095
methyl N-(2-iodo-2-oxoethyl)carbamate
CID 90151465
tert-butyl N-(2-amino-2-oxoethyl)carbamate;ethane;prop-1-ene
CID 144701048
methyl N-[2-[(2-amino-2-oxoethyl)-butylamino]-2-oxoethyl]carbamate
CID 47307690
methyl N-[[4-[(2-amino-2-oxoethyl)carbamoyl]phenyl]methyl]carbamate
CID 110474058
methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate;propane
CID 144755686
methyl N-[(ethoxycarbonylamino)methyl]carbamate
CID 18709961
methyl N-[2-(butylamino)prop-2-enyl]carbamate;propane
CID 144506375
N-(2-amino-2-oxoethyl)-2,2-dichloropropanamide
CID 130754670
2-(ethoxycarbonylamino)acetic acid;propane
CID 145279324

Frequently Asked Questions

What is the IUPAC name of methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane?
The IUPAC name of methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane (CID 144526153) is methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane.
What is the SMILES notation for methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane?
The canonical SMILES for methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane is CCC.CN.COC(=O)NCC(N)=O.
What is the InChIKey of methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane?
The InChIKey is MZHAMIPJXCLERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O3.C3H8.CH5N/c1-9-4(8)6-2-3(5)7;1-3-2;1-2/h2H2,1H3,(H2,5,7)(H,6,8);3H2,1-2H3;2H2,1H3.
What are the key properties of methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane?
methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane has a molecular weight of 207.27 g/mol, XLogP of -0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;methyl N-(2-amino-2-oxoethyl)carbamate;propane is sourced from PubChem (CID 144526153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).