N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine

C18H28N4 — CID 12975075

IUPACN-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine
SMILESCCN(CC)Cc1ccc2ccc(CN(CC)CC)nc2n1
InChIInChI=1S/C18H28N4/c1-5-21(6-2)13-16-11-9-15-10-12-17(20-18(15)19-16)14-22(7-3)8-4/h9-12H,5-8,13-14H2,1-4H3
InChIKeyPFBSXRRXRFPUJI-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.31
Rot. Bonds8

About N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine

N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine (PubChem CID 12975075) has the molecular formula C18H28N4 and a molecular weight of 300.45 g/mol. Its IUPAC name is N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine
PubChem CID12975075
Molecular FormulaC18H28N4
Molecular Weight300.45 g/mol
Exact Mass300.23
IUPAC NameN-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine
SMILESCCN(CC)Cc1ccc2ccc(CN(CC)CC)nc2n1
InChIInChI=1S/C18H28N4/c1-5-21(6-2)13-16-11-9-15-10-12-17(20-18(15)19-16)14-22(7-3)8-4/h9-12H,5-8,13-14H2,1-4H3
InChIKeyPFBSXRRXRFPUJI-UHFFFAOYSA-N
XLogP3.31
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N'-diethyl-N,N'-bis(quinolin-2-ylmethyl)ethane-1,2-diamine
CID 101381014
N-ethyl-N-[(6-propan-2-yl-2-pyridinyl)methyl]ethanamine
CID 138538363
N-ethyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)ethanamine
CID 4701920
N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 91774737
2-[ethyl(quinolin-2-ylmethyl)amino]-N'-hydroxyethanimidamide
CID 76928803
N-[(6-chloropyridazin-3-yl)methyl]-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 104513798
N-benzyl-N-[[7-[[benzyl-[2-(1-methylbenzimidazol-2-yl)ethyl]amino]methyl]-1,8-naphthyridin-2-yl]methyl]-2-(1-methylbenzimidazol-2-yl)ethanamine
CID 12975078
[ethyl(pyridin-2-ylmethyl)amino]methanol
CID 20707216
N-[(5-bromo-2-pyridinyl)methyl]-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 113254240
2-ethoxy-N-ethyl-N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]ethanamine
CID 106906611
2-[[6-[6-[[bis(carboxymethyl)amino]methyl]-2-pyridinyl]-2-pyridinyl]methyl-ethylamino]acetic acid
CID 54257408
N-ethyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]propan-1-amine
CID 106905733

Frequently Asked Questions

What is the IUPAC name of N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine?
The IUPAC name of N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine (CID 12975075) is N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine.
What is the SMILES notation for N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine?
The canonical SMILES for N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine is CCN(CC)Cc1ccc2ccc(CN(CC)CC)nc2n1.
What is the InChIKey of N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine?
The InChIKey is PFBSXRRXRFPUJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4/c1-5-21(6-2)13-16-11-9-15-10-12-17(20-18(15)19-16)14-22(7-3)8-4/h9-12H,5-8,13-14H2,1-4H3.
What are the key properties of N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine?
N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine has a molecular weight of 300.45 g/mol, XLogP of 3.31, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[7-(diethylaminomethyl)-1,8-naphthyridin-2-yl]methyl]-N-ethylethanamine is sourced from PubChem (CID 12975075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).