N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide

C9H17NO2 — CID 115606636

IUPACN-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide
SMILESCOCC(C)(C)NC(=O)C1CC1
InChIInChI=1S/C9H17NO2/c1-9(2,6-12-3)10-8(11)7-4-5-7/h7H,4-6H2,1-3H3,(H,10,11)
InChIKeyPLVDPUVPZUHUPD-UHFFFAOYSA-N
MW171.24 g/mol
LogP0.94
Rot. Bonds4

About N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide

N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide (PubChem CID 115606636) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide
PubChem CID115606636
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC NameN-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide
SMILESCOCC(C)(C)NC(=O)C1CC1
InChIInChI=1S/C9H17NO2/c1-9(2,6-12-3)10-8(11)7-4-5-7/h7H,4-6H2,1-3H3,(H,10,11)
InChIKeyPLVDPUVPZUHUPD-UHFFFAOYSA-N
XLogP0.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(1-methoxy-2-methylpropan-2-yl)carbamoyl]-4-methylcyclopentane-1-carboxylic acid
CID 114391355
N-(2-methyl-1-methylsulfanylpropan-2-yl)cyclopropanecarboxamide
CID 167004925
2-cyclopropyl-1-(1-methoxy-2-methylpropan-2-yl)guanidine
CID 115629390
2-(4-aminocyclohexyl)-N-(1-methoxy-2-methylpropan-2-yl)acetamide
CID 113470824
N-(1-methoxy-2-methylpropan-2-yl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 136533103
N-(1-methoxy-2-methylpropan-2-yl)-2-piperidin-4-ylacetamide
CID 115738831
2-(azetidin-3-yl)-N-(1-methoxy-2-methylpropan-2-yl)acetamide
CID 115738814
1-(1-methoxy-2-methylpropan-2-yl)-3-methylurea
CID 115690659
N-(1-methoxy-2-methylpropan-2-yl)-4-(propylamino)oxolane-3-carboxamide
CID 113470440
3-[(4,4-difluorocyclohexanecarbonyl)amino]-4-methoxy-3-methylbutanoic acid
CID 120532395
4-N-tert-butyl-1-N-(3-methoxypropyl)cyclohexane-1,4-dicarboxamide
CID 109146641
4-tert-butyl-N-(4-hydroxy-2-methylbutan-2-yl)cyclohexane-1-carboxamide
CID 115968764

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide (CID 115606636) is N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide is COCC(C)(C)NC(=O)C1CC1.
What is the InChIKey of N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide?
The InChIKey is PLVDPUVPZUHUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-9(2,6-12-3)10-8(11)7-4-5-7/h7H,4-6H2,1-3H3,(H,10,11).
What are the key properties of N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide?
N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide has a molecular weight of 171.24 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxy-2-methylpropan-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 115606636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).