N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine

C11H20N2 — CID 89141386

IUPACN-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine
SMILESCCCN(CC)C1C=C(C)C=CN1
InChIInChI=1S/C11H20N2/c1-4-8-13(5-2)11-9-10(3)6-7-12-11/h6-7,9,11-12H,4-5,8H2,1-3H3
InChIKeyBCDRGSJBQNBEBV-UHFFFAOYSA-N
MW180.30 g/mol
LogP2.11
Rot. Bonds4

About N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine

N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine (PubChem CID 89141386) has the molecular formula C11H20N2 and a molecular weight of 180.30 g/mol. Its IUPAC name is N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine
PubChem CID89141386
Molecular FormulaC11H20N2
Molecular Weight180.30 g/mol
Exact Mass180.16
IUPAC NameN-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine
SMILESCCCN(CC)C1C=C(C)C=CN1
InChIInChI=1S/C11H20N2/c1-4-8-13(5-2)11-9-10(3)6-7-12-11/h6-7,9,11-12H,4-5,8H2,1-3H3
InChIKeyBCDRGSJBQNBEBV-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine?
The IUPAC name of N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine (CID 89141386) is N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine?
The canonical SMILES for N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine is CCCN(CC)C1C=C(C)C=CN1.
What is the InChIKey of N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine?
The InChIKey is BCDRGSJBQNBEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-4-8-13(5-2)11-9-10(3)6-7-12-11/h6-7,9,11-12H,4-5,8H2,1-3H3.
What are the key properties of N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine?
N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine has a molecular weight of 180.30 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-N-propyl-1,2-dihydropyridin-2-amine is sourced from PubChem (CID 89141386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).