7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine

C19H27N5O — CID 11727574

IUPAC7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine
SMILESCOc1ccc2c(CN3CCNCC3)cc(N3CCCCC3)nc2n1
InChIInChI=1S/C19H27N5O/c1-25-18-6-5-16-15(14-23-11-7-20-8-12-23)13-17(21-19(16)22-18)24-9-3-2-4-10-24/h5-6,13,20H,2-4,7-12,14H2,1H3
InChIKeyNHKFWSBIMPZVMW-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.03
Rot. Bonds4

About 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine

7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine (PubChem CID 11727574) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine.

Molecular Properties

Compound Name7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine
PubChem CID11727574
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine
SMILESCOc1ccc2c(CN3CCNCC3)cc(N3CCCCC3)nc2n1
InChIInChI=1S/C19H27N5O/c1-25-18-6-5-16-15(14-23-11-7-20-8-12-23)13-17(21-19(16)22-18)24-9-3-2-4-10-24/h5-6,13,20H,2-4,7-12,14H2,1H3
InChIKeyNHKFWSBIMPZVMW-UHFFFAOYSA-N
XLogP2.03
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-methoxy-2-(piperazin-1-ylmethyl)-1H-imidazo[4,5-b]pyridine
CID 65483646
1-[(2,6-dimethoxy-4-pyridinyl)methyl]piperazine
CID 84700154
3-methoxy-5-(piperazin-1-ylmethyl)-1,2-oxazole
CID 96621570
1-[(2-methoxy-3-pyridinyl)methyl]piperazine
CID 22032016
1-[(2-methoxy-3,4-dimethylphenyl)methyl]piperazine
CID 59161326
1-[(5-chloro-2-methoxy-3-methylphenyl)methyl]piperazine
CID 3437314
4-methoxy-2-(1,4,7-triazonan-1-ylmethyl)phenol
CID 165144364
1-[(3-fluoro-2,4,5-trimethoxyphenyl)methyl]piperazine
CID 117457867
1-[(5-chloro-3-ethyl-2-methoxyphenyl)methyl]piperazine
CID 117425714
1-[(2,4,5-trimethoxyphenyl)methyl]piperazine;hydrochloride
CID 46736385
1-[(5-ethyl-2,3-dimethoxyphenyl)methyl]piperazine
CID 117415820
1-[(5-chloro-3-fluoro-2,4-dimethoxyphenyl)methyl]piperazine
CID 117466502

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine?
The IUPAC name of 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine (CID 11727574) is 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine.
What is the SMILES notation for 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine?
The canonical SMILES for 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine is COc1ccc2c(CN3CCNCC3)cc(N3CCCCC3)nc2n1.
What is the InChIKey of 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine?
The InChIKey is NHKFWSBIMPZVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-25-18-6-5-16-15(14-23-11-7-20-8-12-23)13-17(21-19(16)22-18)24-9-3-2-4-10-24/h5-6,13,20H,2-4,7-12,14H2,1H3.
What are the key properties of 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine?
7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine has a molecular weight of 341.46 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-(piperazin-1-ylmethyl)-2-piperidin-1-yl-1,8-naphthyridine is sourced from PubChem (CID 11727574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).