3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide

C15H27N7O2 — CID 67532507

IUPAC3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide
SMILESNCCN(CCN)C(=O)c1cncc(C(=O)N(CCN)CCN)c1
InChIInChI=1S/C15H27N7O2/c16-1-5-21(6-2-17)14(23)12-9-13(11-20-10-12)15(24)22(7-3-18)8-4-19/h9-11H,1-8,16-19H2
InChIKeyAWWWEZAUGSQVNB-UHFFFAOYSA-N
MW337.43 g/mol
LogP-2.20
Rot. Bonds10

About 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide

3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide (PubChem CID 67532507) has the molecular formula C15H27N7O2 and a molecular weight of 337.43 g/mol. Its IUPAC name is 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide
PubChem CID67532507
Molecular FormulaC15H27N7O2
Molecular Weight337.43 g/mol
Exact Mass337.22
IUPAC Name3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide
SMILESNCCN(CCN)C(=O)c1cncc(C(=O)N(CCN)CCN)c1
InChIInChI=1S/C15H27N7O2/c16-1-5-21(6-2-17)14(23)12-9-13(11-20-10-12)15(24)22(7-3-18)8-4-19/h9-11H,1-8,16-19H2
InChIKeyAWWWEZAUGSQVNB-UHFFFAOYSA-N
XLogP-2.20
TPSA157.59 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 5-2.20
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-aminoethyl)-5-fluoro-N-(2-phenylethyl)pyridine-3-carboxamide;dihydrochloride
CID 120885347
N-(2-aminoethyl)-N-butylpyrimidine-5-carboxamide
CID 102922881
N-(2-aminoethyl)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 120885554
3-N,5-N-bis(2-hydroxyethyl)-3-N,5-N-dimethylpyridine-3,5-dicarboxamide
CID 22458041
3-N-pentyl-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109107218
5-bromo-N,N-dihexylpyridine-3-carboxamide
CID 132587531
N-(3-aminopropyl)-N-benzyl-5-fluoropyridine-3-carboxamide
CID 107365924
5-chloro-N-(2-hydroxyethyl)-N-propylpyridine-3-carboxamide
CID 70463058
5-(4-chloroanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109240944
3-N-(3-methoxypropyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109103626
3-N-[2-(2-fluorophenyl)ethyl]-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109106315
3-N-(2,4-difluorophenyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109107640

Frequently Asked Questions

What is the IUPAC name of 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide (CID 67532507) is 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide is NCCN(CCN)C(=O)c1cncc(C(=O)N(CCN)CCN)c1.
What is the InChIKey of 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide?
The InChIKey is AWWWEZAUGSQVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N7O2/c16-1-5-21(6-2-17)14(23)12-9-13(11-20-10-12)15(24)22(7-3-18)8-4-19/h9-11H,1-8,16-19H2.
What are the key properties of 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide?
3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide has a molecular weight of 337.43 g/mol, XLogP of -2.20, 10 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N,5-N,5-N-tetrakis(2-aminoethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 67532507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).