2-methylpropan-1-amine;N-(2-methylpropyl)acetamide

C10H24N2O — CID 161466003

IUPAC2-methylpropan-1-amine;N-(2-methylpropyl)acetamide
SMILESCC(=O)NCC(C)C.CC(C)CN
InChIInChI=1S/C6H13NO.C4H11N/c1-5(2)4-7-6(3)8;1-4(2)3-5/h5H,4H2,1-3H3,(H,7,8);4H,3,5H2,1-2H3
InChIKeyWCLFAKGIUBBSEW-UHFFFAOYSA-N
MW188.31 g/mol
LogP1.38
Rot. Bonds3

About 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide

2-methylpropan-1-amine;N-(2-methylpropyl)acetamide (PubChem CID 161466003) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-methylpropan-1-amine;N-(2-methylpropyl)acetamide
PubChem CID161466003
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name2-methylpropan-1-amine;N-(2-methylpropyl)acetamide
SMILESCC(=O)NCC(C)C.CC(C)CN
InChIInChI=1S/C6H13NO.C4H11N/c1-5(2)4-7-6(3)8;1-4(2)3-5/h5H,4H2,1-3H3,(H,7,8);4H,3,5H2,1-2H3
InChIKeyWCLFAKGIUBBSEW-UHFFFAOYSA-N
XLogP1.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N-(2-methylpropyl)acetamide
CID 142232237
N-(3-acetamido-2-methylpropyl)acetamide
CID 20588188
acetic acid;copper;2-methylpropan-1-amine
CID 88782115
1,3-dimethoxypropane;ethane;N-(2-methylpropyl)acetamide;molecular hydrogen
CID 169251341
acetic acid;methane;bis(2-methylbutan-1-amine);N-(2-methylbutyl)acetamide
CID 167598192
N-(2-amino-2-sulfanylethyl)acetamide
CID 175821750
N-(2,3-dihydroxybutyl)acetamide
CID 91533638
ethyl (2S)-3-acetamido-2-methylpropanoate
CID 15606037
N-[2-(1-aminopropan-2-ylamino)ethyl]acetamide
CID 103387588
N-(2-methoxypropyl)acetamide
CID 90876780
N-[(2R)-2,3,3-trimethylbutyl]acetamide
CID 59118608
1-(3-aminopropyl)-3-(2-methylpropyl)urea
CID 117235685

Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide?
The IUPAC name of 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide (CID 161466003) is 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide is CC(=O)NCC(C)C.CC(C)CN.
What is the InChIKey of 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide?
The InChIKey is WCLFAKGIUBBSEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO.C4H11N/c1-5(2)4-7-6(3)8;1-4(2)3-5/h5H,4H2,1-3H3,(H,7,8);4H,3,5H2,1-2H3.
What are the key properties of 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide?
2-methylpropan-1-amine;N-(2-methylpropyl)acetamide has a molecular weight of 188.31 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-1-amine;N-(2-methylpropyl)acetamide is sourced from PubChem (CID 161466003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).