N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

C12H20N4 — CID 106619840

IUPACN-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCCCN(CC1CCCN1)c1cccnn1
InChIInChI=1S/C12H20N4/c1-2-9-16(10-11-5-3-7-13-11)12-6-4-8-14-15-12/h4,6,8,11,13H,2-3,5,7,9-10H2,1H3
InChIKeyHSPRQRAKGBARQN-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.45
Rot. Bonds5

About N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (PubChem CID 106619840) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
PubChem CID106619840
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCCCN(CC1CCCN1)c1cccnn1
InChIInChI=1S/C12H20N4/c1-2-9-16(10-11-5-3-7-13-11)12-6-4-8-14-15-12/h4,6,8,11,13H,2-3,5,7,9-10H2,1H3
InChIKeyHSPRQRAKGBARQN-UHFFFAOYSA-N
XLogP1.45
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-N-(pyrrolidin-2-ylmethyl)pyrido[2,3-b]pyrazin-6-amine
CID 106619672
5,6-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrazin-2-amine
CID 106619724
N-propyl-N-(pyrrolidin-2-ylmethyl)isoquinolin-1-amine
CID 106619613
6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridine-2-carboxamide
CID 106620470
6-propan-2-yl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 106619805
3-bromo-N-propyl-N-(pyrrolidin-2-ylmethyl)pyridin-4-amine
CID 106619617
2-[piperidin-2-ylmethyl(propyl)amino]pyridine-4-carboxamide
CID 106642290
N-ethyl-6-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106619421
N-(piperidin-2-ylmethyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 106642582
N-butyl-6-ethoxy-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106620441
6-[butyl(pyrrolidin-2-ylmethyl)amino]pyridazine-3-carboxamide
CID 106620429
2-[propyl(pyrrolidin-2-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 107552774

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The IUPAC name of N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (CID 106619840) is N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The canonical SMILES for N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is CCCN(CC1CCCN1)c1cccnn1.
What is the InChIKey of N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The InChIKey is HSPRQRAKGBARQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-2-9-16(10-11-5-3-7-13-11)12-6-4-8-14-15-12/h4,6,8,11,13H,2-3,5,7,9-10H2,1H3.
What are the key properties of N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 106619840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).