methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane

C9H22N2O2 — CID 161126143

IUPACmethyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane
SMILESCC(C)C.CNCCN(C)C(=O)O
InChIInChI=1S/C5H12N2O2.C4H10/c1-6-3-4-7(2)5(8)9;1-4(2)3/h6H,3-4H2,1-2H3,(H,8,9);4H,1-3H3
InChIKeyULOULRPFEFYMSA-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.48
Rot. Bonds3

About methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane

methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane (PubChem CID 161126143) has the molecular formula C9H22N2O2 and a molecular weight of 190.29 g/mol. Its IUPAC name is methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane.

Molecular Properties

Compound Namemethyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane
PubChem CID161126143
Molecular FormulaC9H22N2O2
Molecular Weight190.29 g/mol
Exact Mass190.17
IUPAC Namemethyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane
SMILESCC(C)C.CNCCN(C)C(=O)O
InChIInChI=1S/C5H12N2O2.C4H10/c1-6-3-4-7(2)5(8)9;1-4(2)3/h6H,3-4H2,1-2H3,(H,8,9);4H,1-3H3
InChIKeyULOULRPFEFYMSA-UHFFFAOYSA-N
XLogP1.48
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl-[3-(methylamino)propyl]carbamic acid
CID 18404327
methyl-[2-(methylamino)ethyl]carbamothioic S-acid
CID 55299053
2-hydroxy-N-methyl-N-[2-(methylamino)ethyl]acetamide
CID 87509746
3-methyl-4-[[methyl-[2-(methylamino)ethyl]carbamoyl]amino]butanoic acid
CID 81069981
methane;N-methyl-2-(methylamino)-N-[2-(methylamino)ethyl]acetamide
CID 160845776
2-methyl-5-[[methyl-[2-(methylamino)ethyl]carbamoyl]amino]pentanoic acid
CID 104686710
4-amino-5-[methyl-[2-(methylamino)ethyl]amino]-5-oxopentanoic acid
CID 64889359
3-(4-aminophenyl)-N-methyl-N-[2-(methylamino)ethyl]butanamide
CID 104502669
N,3-dimethyl-N-[2-(methylamino)ethyl]piperidine-1-carboxamide
CID 79163646
2-[[[methyl-[2-(methylamino)ethyl]carbamoyl]amino]methyl]pentanoic acid
CID 65226283
2-[(2,4-diamino-4-oxobutanoyl)amino]ethyl-methylcarbamic acid
CID 87306158
2,2-dimethyl-3-[[methyl-[2-(methylamino)ethyl]carbamoyl]amino]propanoic acid
CID 115428852

Frequently Asked Questions

What is the IUPAC name of methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane?
The IUPAC name of methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane (CID 161126143) is methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane.
What is the SMILES notation for methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane?
The canonical SMILES for methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane is CC(C)C.CNCCN(C)C(=O)O.
What is the InChIKey of methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane?
The InChIKey is ULOULRPFEFYMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2.C4H10/c1-6-3-4-7(2)5(8)9;1-4(2)3/h6H,3-4H2,1-2H3,(H,8,9);4H,1-3H3.
What are the key properties of methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane?
methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane has a molecular weight of 190.29 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[2-(methylamino)ethyl]carbamic acid;2-methylpropane is sourced from PubChem (CID 161126143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).