N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine

C14H23N5 — CID 58227216

IUPACN-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
SMILESCN[C@H]1CCN(c2cnnc(NC3CCCC3)c2)C1
InChIInChI=1S/C14H23N5/c1-15-12-6-7-19(10-12)13-8-14(18-16-9-13)17-11-4-2-3-5-11/h8-9,11-12,15H,2-7,10H2,1H3,(H,17,18)/t12-/m0/s1
InChIKeyQLDXTDXXBCKZJH-LBPRGKRZSA-N
MW261.37 g/mol
LogP1.63
Rot. Bonds4

About N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine

N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine (PubChem CID 58227216) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
PubChem CID58227216
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC NameN-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
SMILESCN[C@H]1CCN(c2cnnc(NC3CCCC3)c2)C1
InChIInChI=1S/C14H23N5/c1-15-12-6-7-19(10-12)13-8-14(18-16-9-13)17-11-4-2-3-5-11/h8-9,11-12,15H,2-7,10H2,1H3,(H,17,18)/t12-/m0/s1
InChIKeyQLDXTDXXBCKZJH-LBPRGKRZSA-N
XLogP1.63
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-bicyclo[2.2.1]heptanyl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227259
N-(2-bicyclo[2.2.1]heptanyl)-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227086
5-[(3S)-3-(methylamino)pyrrolidin-1-yl]-N-(2-methylpropyl)pyridazin-3-amine
CID 58227207
N-cyclopentyl-5-(4-methylpiperazin-1-yl)pyridazin-3-amine
CID 58227242
N-cyclopentyl-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227337
5-[(3R)-3-(methylamino)pyrrolidin-1-yl]-N-(2-methylpropyl)pyridazin-3-amine
CID 67087450
2-Pyridazin-3-yl-2,5-diazabicyclo[2.2.1]heptane
CID 44427084
5-(4-methylpiperazin-1-yl)-N-(2-methylpropyl)pyridazin-3-amine
CID 58227158
N-cyclohexyl-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227193
N-butyl-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227362
N-(cyclopropylmethyl)-5-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine
CID 58227385
N-methyl-1-(pyridazin-3-yl)piperidin-4-amine
CID 54594801

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine?
The IUPAC name of N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine (CID 58227216) is N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine.
What is the SMILES notation for N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine?
The canonical SMILES for N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine is CN[C@H]1CCN(c2cnnc(NC3CCCC3)c2)C1.
What is the InChIKey of N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine?
The InChIKey is QLDXTDXXBCKZJH-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H23N5/c1-15-12-6-7-19(10-12)13-8-14(18-16-9-13)17-11-4-2-3-5-11/h8-9,11-12,15H,2-7,10H2,1H3,(H,17,18)/t12-/m0/s1.
What are the key properties of N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine?
N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine has a molecular weight of 261.37 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[(3S)-3-(methylamino)pyrrolidin-1-yl]pyridazin-3-amine is sourced from PubChem (CID 58227216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).