1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine

C14H20N4 — CID 69131245

IUPAC1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine
SMILESCN(C)CCC(C)(N)c1ccc2ncccc2n1
InChIInChI=1S/C14H20N4/c1-14(15,8-10-18(2)3)13-7-6-11-12(17-13)5-4-9-16-11/h4-7,9H,8,10,15H2,1-3H3
InChIKeyWOEWSXKAKHDCDN-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.76
Rot. Bonds4

About 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine

1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine (PubChem CID 69131245) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine.

Molecular Properties

Compound Name1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine
PubChem CID69131245
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine
SMILESCN(C)CCC(C)(N)c1ccc2ncccc2n1
InChIInChI=1S/C14H20N4/c1-14(15,8-10-18(2)3)13-7-6-11-12(17-13)5-4-9-16-11/h4-7,9H,8,10,15H2,1-3H3
InChIKeyWOEWSXKAKHDCDN-UHFFFAOYSA-N
XLogP1.76
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine?
The IUPAC name of 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine (CID 69131245) is 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine.
What is the SMILES notation for 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine?
The canonical SMILES for 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine is CN(C)CCC(C)(N)c1ccc2ncccc2n1.
What is the InChIKey of 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine?
The InChIKey is WOEWSXKAKHDCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-14(15,8-10-18(2)3)13-7-6-11-12(17-13)5-4-9-16-11/h4-7,9H,8,10,15H2,1-3H3.
What are the key properties of 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine?
1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine has a molecular weight of 244.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dimethyl-3-(1,5-naphthyridin-2-yl)butane-1,3-diamine is sourced from PubChem (CID 69131245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).