N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine

C15H26N2 — CID 114246475

IUPACN-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine
SMILESCCCCC(C)C(Cc1ccncc1)NCC
InChIInChI=1S/C15H26N2/c1-4-6-7-13(3)15(17-5-2)12-14-8-10-16-11-9-14/h8-11,13,15,17H,4-7,12H2,1-3H3
InChIKeyZAMOLQCDMAEVPC-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.43
Rot. Bonds8

About N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine

N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine (PubChem CID 114246475) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine
PubChem CID114246475
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC NameN-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine
SMILESCCCCC(C)C(Cc1ccncc1)NCC
InChIInChI=1S/C15H26N2/c1-4-6-7-13(3)15(17-5-2)12-14-8-10-16-11-9-14/h8-11,13,15,17H,4-7,12H2,1-3H3
InChIKeyZAMOLQCDMAEVPC-UHFFFAOYSA-N
XLogP3.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(3-fluorophenyl)-3-methylheptan-2-amine
CID 114246287
N-propan-2-yl-1-pyridin-4-ylhexan-2-amine
CID 79411774
N-ethyl-4,4,4-trifluoro-1-pyridin-4-yl-3-(trifluoromethyl)butan-2-amine
CID 103312085
(4S)-N-ethyl-5-methylnonan-4-amine
CID 138564824
N-ethyl-2-methyl-1-pyridin-4-ylpentan-1-amine
CID 107893389
N-ethyl-5-methyltridecan-6-amine
CID 114246331
N-ethyl-4-methyl-1-pyridin-4-ylpent-3-en-2-amine
CID 79190966
N-(pyridin-4-ylmethyl)heptan-3-amine
CID 63947303
4-(2-chloro-3-methylhexyl)pyridine
CID 66459985
(5-methoxy-3-methyl-1-pyridin-4-ylpentan-2-yl)hydrazine
CID 105212316
N-methyl-1-pyridin-4-yldecan-2-amine
CID 62605644
N-ethyl-5-methoxy-3-methyl-1-[4-(trifluoromethyl)phenyl]pentan-2-amine
CID 105044327

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine?
The IUPAC name of N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine (CID 114246475) is N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine?
The canonical SMILES for N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine is CCCCC(C)C(Cc1ccncc1)NCC.
What is the InChIKey of N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine?
The InChIKey is ZAMOLQCDMAEVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-6-7-13(3)15(17-5-2)12-14-8-10-16-11-9-14/h8-11,13,15,17H,4-7,12H2,1-3H3.
What are the key properties of N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine?
N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine has a molecular weight of 234.39 g/mol, XLogP of 3.43, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-1-pyridin-4-ylheptan-2-amine is sourced from PubChem (CID 114246475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).