N-methyl-N-propyl-3,4-dihydropyridin-4-amine

C9H16N2 — CID 143108219

IUPACN-methyl-N-propyl-3,4-dihydropyridin-4-amine
SMILESCCCN(C)C1C=CN=CC1
InChIInChI=1S/C9H16N2/c1-3-8-11(2)9-4-6-10-7-5-9/h4,6-7,9H,3,5,8H2,1-2H3
InChIKeyCZJYQCAJUYYJMH-UHFFFAOYSA-N
MW152.24 g/mol
LogP1.68
Rot. Bonds3

About N-methyl-N-propyl-3,4-dihydropyridin-4-amine

N-methyl-N-propyl-3,4-dihydropyridin-4-amine (PubChem CID 143108219) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is N-methyl-N-propyl-3,4-dihydropyridin-4-amine.

Molecular Properties

Compound NameN-methyl-N-propyl-3,4-dihydropyridin-4-amine
PubChem CID143108219
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC NameN-methyl-N-propyl-3,4-dihydropyridin-4-amine
SMILESCCCN(C)C1C=CN=CC1
InChIInChI=1S/C9H16N2/c1-3-8-11(2)9-4-6-10-7-5-9/h4,6-7,9H,3,5,8H2,1-2H3
InChIKeyCZJYQCAJUYYJMH-UHFFFAOYSA-N
XLogP1.68
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57239418
1-ethyl-N-propan-2-yl-2,4-dihydropyridin-3-imine
CID 57244631
N-ethyl-N,3-dimethyl-3,4-dihydropyridin-4-amine
CID 70331366
1-(3,4-Dihydropyridin-4-yl)-4-methylpiperazine
CID 89062051
4-(Dimethylamino)-3,4-dihydropyridin-1-ium-1-carbonitrile
CID 89244997
4-Piperidin-1-yl-3,4-dihydropyridine
CID 123320641
N-ethyl-N-methyl-3,4-dihydropyridin-5-amine
CID 126549665
(Z)-N,N-dimethyl-4-(propylideneamino)but-3-en-2-amine
CID 134357498
4-N,4-N,4-N',4-N'-tetramethyl-3H-pyridine-4,4-diamine
CID 138706416
N-propyl-3,4-dihydropyridin-4-amine
CID 143106681
3,4-dihydropyridin-4-amine;N,N-dimethylmethanamine
CID 143835654
N-(3,4-dihydropyridin-3-ylmethyl)-N-ethylethanamine
CID 143866626

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propyl-3,4-dihydropyridin-4-amine?
The IUPAC name of N-methyl-N-propyl-3,4-dihydropyridin-4-amine (CID 143108219) is N-methyl-N-propyl-3,4-dihydropyridin-4-amine.
What is the SMILES notation for N-methyl-N-propyl-3,4-dihydropyridin-4-amine?
The canonical SMILES for N-methyl-N-propyl-3,4-dihydropyridin-4-amine is CCCN(C)C1C=CN=CC1.
What is the InChIKey of N-methyl-N-propyl-3,4-dihydropyridin-4-amine?
The InChIKey is CZJYQCAJUYYJMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-8-11(2)9-4-6-10-7-5-9/h4,6-7,9H,3,5,8H2,1-2H3.
What are the key properties of N-methyl-N-propyl-3,4-dihydropyridin-4-amine?
N-methyl-N-propyl-3,4-dihydropyridin-4-amine has a molecular weight of 152.24 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propyl-3,4-dihydropyridin-4-amine is sourced from PubChem (CID 143108219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).