N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine

C12H18N2 — CID 115695351

IUPACN-(2-cyclopropylpropyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(NCC(C)C2CC2)c1
InChIInChI=1S/C12H18N2/c1-9-5-6-13-12(7-9)14-8-10(2)11-3-4-11/h5-7,10-11H,3-4,8H2,1-2H3,(H,13,14)
InChIKeyMCSDOCOWNWMPAY-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.85
Rot. Bonds4

About N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine

N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine (PubChem CID 115695351) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-4-methylpyridin-2-amine
PubChem CID115695351
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN-(2-cyclopropylpropyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(NCC(C)C2CC2)c1
InChIInChI=1S/C12H18N2/c1-9-5-6-13-12(7-9)14-8-10(2)11-3-4-11/h5-7,10-11H,3-4,8H2,1-2H3,(H,13,14)
InChIKeyMCSDOCOWNWMPAY-UHFFFAOYSA-N
XLogP2.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine?
The IUPAC name of N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine (CID 115695351) is N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine.
What is the SMILES notation for N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine?
The canonical SMILES for N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine is Cc1ccnc(NCC(C)C2CC2)c1.
What is the InChIKey of N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine?
The InChIKey is MCSDOCOWNWMPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-5-6-13-12(7-9)14-8-10(2)11-3-4-11/h5-7,10-11H,3-4,8H2,1-2H3,(H,13,14).
What are the key properties of N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine?
N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine has a molecular weight of 190.29 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 115695351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).