N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine

C14H28N2 — CID 15068659

IUPACN,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine
SMILESCCCCN(CCCC)C1=CCN(C)CC1
InChIInChI=1S/C14H28N2/c1-4-6-10-16(11-7-5-2)14-8-12-15(3)13-9-14/h8H,4-7,9-13H2,1-3H3
InChIKeyIDLAZFFNEPGPOW-UHFFFAOYSA-N
MW224.39 g/mol
LogP3.11
Rot. Bonds7

About N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine

N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine (PubChem CID 15068659) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine.

Molecular Properties

Compound NameN,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine
PubChem CID15068659
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine
SMILESCCCCN(CCCC)C1=CCN(C)CC1
InChIInChI=1S/C14H28N2/c1-4-6-10-16(11-7-5-2)14-8-12-15(3)13-9-14/h8H,4-7,9-13H2,1-3H3
InChIKeyIDLAZFFNEPGPOW-UHFFFAOYSA-N
XLogP3.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-Dimethyl-4-(piperidin-1-yl)-1,2,3,6-tetrahydropyridin-1-ium iodide
CID 3025240
Pyridine, 1,2,5,6-tetrahydro-4-(2-ethyl-1-aziridinyl)-1-methyl-
CID 5744383
Pyridine, 1,4,5,6-tetrahydro-1,2-dimethyl-
CID 13679998
Pyridine, 1-ethyl-1,2,3,4-tetrahydro-6-methyl-
CID 45087233
1-methyl-4-pyrrolidin-1-yl-3,6-dihydro-2H-pyridine
CID 11768925
1-Methyl-4-dimethylamino-1,2,5,6-tetrahydropyridine
CID 12664027
1-Methyl-6-methylidene-2,5-dihydropyridine
CID 67978398
1-methyl-4-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)piperazine
CID 3715231
1-methyl-N,N-dipropyl-3,6-dihydro-2H-pyridin-4-amine
CID 134830533
1,1-dimethyl-4-piperidin-1-yl-3,6-dihydro-2H-pyridin-1-ium
CID 3025241
1-methyl-4-piperidin-1-yl-3,6-dihydro-2H-pyridine
CID 3064324
1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)azepane
CID 121015097

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine?
The IUPAC name of N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine (CID 15068659) is N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine.
What is the SMILES notation for N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine?
The canonical SMILES for N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine is CCCCN(CCCC)C1=CCN(C)CC1.
What is the InChIKey of N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine?
The InChIKey is IDLAZFFNEPGPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-6-10-16(11-7-5-2)14-8-12-15(3)13-9-14/h8H,4-7,9-13H2,1-3H3.
What are the key properties of N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine?
N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine has a molecular weight of 224.39 g/mol, XLogP of 3.11, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridin-4-amine is sourced from PubChem (CID 15068659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).