N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine

C10H23N3 — CID 117237610

IUPACN',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine
SMILESCN(C)CC(CN)C1CCN(C)C1
InChIInChI=1S/C10H23N3/c1-12(2)7-10(6-11)9-4-5-13(3)8-9/h9-10H,4-8,11H2,1-3H3
InChIKeyYGGHOFAUBIPILC-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.07
Rot. Bonds4

About N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine

N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine (PubChem CID 117237610) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine
PubChem CID117237610
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC NameN',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine
SMILESCN(C)CC(CN)C1CCN(C)C1
InChIInChI=1S/C10H23N3/c1-12(2)7-10(6-11)9-4-5-13(3)8-9/h9-10H,4-8,11H2,1-3H3
InChIKeyYGGHOFAUBIPILC-UHFFFAOYSA-N
XLogP0.07
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N',N'-dimethyl-2-(1-methylpiperidin-4-yl)propane-1,3-diamine
CID 117239062
2-cyclobutyl-N',N'-dimethylpropane-1,3-diamine
CID 117245609
2-cycloheptyl-N',N'-dimethylpropane-1,3-diamine
CID 165466127
2-(dimethylamino)-1-(1-methylpiperidin-4-yl)ethanol
CID 117238580
N,N-dimethyl-1-(1-methylpiperidin-4-yl)ethane-1,2-diamine
CID 82406005
2-(1-methylpiperidin-4-yl)-3-methylsulfanylpropan-1-amine
CID 117239456
2-(1-propan-2-ylpyrrolidin-3-yl)propane-1,3-diamine
CID 117237616
N',2-dimethyl-N'-[(1-methylpyrrolidin-3-yl)methyl]propane-1,3-diamine
CID 63275885
2-(dimethylamino)-2-(1-methylpyrrolidin-3-yl)ethanol
CID 116857325
2-chloro-N,N-dimethyl-1-(1-methylpyrrolidin-3-yl)ethanamine
CID 116907508
1-methyl-3-propan-2-ylpyrrolidine
CID 21355395
1-cyclopropyl-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethane-1,2-diamine
CID 63276195

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine?
The IUPAC name of N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine (CID 117237610) is N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine.
What is the SMILES notation for N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine?
The canonical SMILES for N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine is CN(C)CC(CN)C1CCN(C)C1.
What is the InChIKey of N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine?
The InChIKey is YGGHOFAUBIPILC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-12(2)7-10(6-11)9-4-5-13(3)8-9/h9-10H,4-8,11H2,1-3H3.
What are the key properties of N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine?
N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine has a molecular weight of 185.31 g/mol, XLogP of 0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-2-(1-methylpyrrolidin-3-yl)propane-1,3-diamine is sourced from PubChem (CID 117237610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).