N-methyl-1-(2-methylpropyl)cyclopropan-1-amine

C8H17N — CID 83681729

IUPACN-methyl-1-(2-methylpropyl)cyclopropan-1-amine
SMILESCNC1(CC(C)C)CC1
InChIInChI=1S/C8H17N/c1-7(2)6-8(9-3)4-5-8/h7,9H,4-6H2,1-3H3
InChIKeyLRPUPGSEHLZAKV-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.78
Rot. Bonds3

About N-methyl-1-(2-methylpropyl)cyclopropan-1-amine

N-methyl-1-(2-methylpropyl)cyclopropan-1-amine (PubChem CID 83681729) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is N-methyl-1-(2-methylpropyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methylpropyl)cyclopropan-1-amine
PubChem CID83681729
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC NameN-methyl-1-(2-methylpropyl)cyclopropan-1-amine
SMILESCNC1(CC(C)C)CC1
InChIInChI=1S/C8H17N/c1-7(2)6-8(9-3)4-5-8/h7,9H,4-6H2,1-3H3
InChIKeyLRPUPGSEHLZAKV-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylpropyl)cyclopropan-1-amine?
The IUPAC name of N-methyl-1-(2-methylpropyl)cyclopropan-1-amine (CID 83681729) is N-methyl-1-(2-methylpropyl)cyclopropan-1-amine.
What is the SMILES notation for N-methyl-1-(2-methylpropyl)cyclopropan-1-amine?
The canonical SMILES for N-methyl-1-(2-methylpropyl)cyclopropan-1-amine is CNC1(CC(C)C)CC1.
What is the InChIKey of N-methyl-1-(2-methylpropyl)cyclopropan-1-amine?
The InChIKey is LRPUPGSEHLZAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-7(2)6-8(9-3)4-5-8/h7,9H,4-6H2,1-3H3.
What are the key properties of N-methyl-1-(2-methylpropyl)cyclopropan-1-amine?
N-methyl-1-(2-methylpropyl)cyclopropan-1-amine has a molecular weight of 127.23 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylpropyl)cyclopropan-1-amine is sourced from PubChem (CID 83681729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).