4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine

C16H18N6 — CID 154649480

IUPAC4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine
SMILESNc1cc(NC2CCCC2)c2ccc(-c3ccn[nH]3)nc2n1
InChIInChI=1S/C16H18N6/c17-15-9-14(19-10-3-1-2-4-10)11-5-6-12(20-16(11)21-15)13-7-8-18-22-13/h5-10H,1-4H2,(H,18,22)(H3,17,19,20,21)
InChIKeyFUQDALABDQYUGD-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.96
Rot. Bonds3

About 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine

4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine (PubChem CID 154649480) has the molecular formula C16H18N6 and a molecular weight of 294.36 g/mol. Its IUPAC name is 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine.

Molecular Properties

Compound Name4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine
PubChem CID154649480
Molecular FormulaC16H18N6
Molecular Weight294.36 g/mol
Exact Mass294.16
IUPAC Name4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine
SMILESNc1cc(NC2CCCC2)c2ccc(-c3ccn[nH]3)nc2n1
InChIInChI=1S/C16H18N6/c17-15-9-14(19-10-3-1-2-4-10)11-5-6-12(20-16(11)21-15)13-7-8-18-22-13/h5-10H,1-4H2,(H,18,22)(H3,17,19,20,21)
InChIKeyFUQDALABDQYUGD-UHFFFAOYSA-N
XLogP2.96
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,5-naphthyridine-2,4-diamine
CID 154649456
7-(1H-pyrazol-5-yl)-4-N-[(3R)-pyrrolidin-3-yl]quinoline-2,4-diamine
CID 137417936
4-N-cyclohexyl-7-(2H-pyrrol-3-yl)quinoline-2,4-diamine
CID 148506480
N-[3-(1H-pyrazol-5-yl)phenyl]cycloheptanamine
CID 43745342
4-N-[3-(3-methylcyclopentyl)butan-2-yl]-7-(1H-pyrazol-5-yl)quinoline-2,4-diamine
CID 154649504
7-N-(cyclopropylmethyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine;hydrochloride
CID 162785059
4-N-cyclohexylpyrido[2,3-d]pyrimidine-4,7-diamine
CID 133407209
5-N-cyclopentyl-3-methylisoquinoline-5,8-diamine
CID 102712921
N-cyclohexyl-2-pyridin-2-ylquinolin-4-amine;dihydrobromide
CID 45052924
7-N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridine-5,7-diamine
CID 162785048
4-N-cyclooctyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80956154
4-N-cyclooctyl-2-methylpyrimidine-4,6-diamine
CID 80786651

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine?
The IUPAC name of 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine (CID 154649480) is 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine.
What is the SMILES notation for 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine?
The canonical SMILES for 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine is Nc1cc(NC2CCCC2)c2ccc(-c3ccn[nH]3)nc2n1.
What is the InChIKey of 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine?
The InChIKey is FUQDALABDQYUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6/c17-15-9-14(19-10-3-1-2-4-10)11-5-6-12(20-16(11)21-15)13-7-8-18-22-13/h5-10H,1-4H2,(H,18,22)(H3,17,19,20,21).
What are the key properties of 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine?
4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine has a molecular weight of 294.36 g/mol, XLogP of 2.96, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-7-(1H-pyrazol-5-yl)-1,8-naphthyridine-2,4-diamine is sourced from PubChem (CID 154649480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).