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N-methylcyclohexanamine;prop-1-en-2-amine

C10H22N2 — CID 142542122

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACN-methylcyclohexanamine;prop-1-en-2-amine
SMILESC=C(C)N.CNC1CCCCC1
InChIInChI=1S/C7H15N.C3H7N/c1-8-7-5-3-2-4-6-7;1-3(2)4/h7-8H,2-6H2,1H3;1,4H2,2H3
InChIKeyQGSKIKHLFMLZJJ-UHFFFAOYSA-N
MW170.30 g/mol
LogP2.02
Rot. Bonds1

About N-methylcyclohexanamine;prop-1-en-2-amine

N-methylcyclohexanamine;prop-1-en-2-amine (PubChem CID 142542122) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-methylcyclohexanamine;prop-1-en-2-amine.

Molecular Properties

Compound NameN-methylcyclohexanamine;prop-1-en-2-amine
PubChem CID142542122
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-methylcyclohexanamine;prop-1-en-2-amine
SMILESC=C(C)N.CNC1CCCCC1
InChIInChI=1S/C7H15N.C3H7N/c1-8-7-5-3-2-4-6-7;1-3(2)4/h7-8H,2-6H2,1H3;1,4H2,2H3
InChIKeyQGSKIKHLFMLZJJ-UHFFFAOYSA-N
XLogP2.02
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methylcyclohexanamine;prop-1-en-2-amine?
The IUPAC name of N-methylcyclohexanamine;prop-1-en-2-amine (CID 142542122) is N-methylcyclohexanamine;prop-1-en-2-amine.
What is the SMILES notation for N-methylcyclohexanamine;prop-1-en-2-amine?
The canonical SMILES for N-methylcyclohexanamine;prop-1-en-2-amine is C=C(C)N.CNC1CCCCC1.
What is the InChIKey of N-methylcyclohexanamine;prop-1-en-2-amine?
The InChIKey is QGSKIKHLFMLZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.C3H7N/c1-8-7-5-3-2-4-6-7;1-3(2)4/h7-8H,2-6H2,1H3;1,4H2,2H3.
What are the key properties of N-methylcyclohexanamine;prop-1-en-2-amine?
N-methylcyclohexanamine;prop-1-en-2-amine has a molecular weight of 170.30 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylcyclohexanamine;prop-1-en-2-amine is sourced from PubChem (CID 142542122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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