N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine

C9H21N3 — CID 79540795

IUPACN'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
SMILESCC(CC1CCCN1)NCCN
InChIInChI=1S/C9H21N3/c1-8(11-6-4-10)7-9-3-2-5-12-9/h8-9,11-12H,2-7,10H2,1H3
InChIKeyYOLQEIVLNHZHCY-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.07
Rot. Bonds5

About N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine

N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine (PubChem CID 79540795) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
PubChem CID79540795
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC NameN'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
SMILESCC(CC1CCCN1)NCCN
InChIInChI=1S/C9H21N3/c1-8(11-6-4-10)7-9-3-2-5-12-9/h8-9,11-12H,2-7,10H2,1H3
InChIKeyYOLQEIVLNHZHCY-UHFFFAOYSA-N
XLogP0.07
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541627
4-methyl-N-(1-pyrrolidin-2-ylpropan-2-yl)pentan-1-amine
CID 79540929
N',N'-di(propan-2-yl)-N-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine
CID 79540106
N-(2-cyclohexylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541429
3-(1-pyrrolidin-2-ylpropan-2-ylamino)propanoic acid
CID 79541025
3,3,3-trifluoro-N-(1-pyrrolidin-2-ylpropan-2-yl)propan-1-amine
CID 79539962
2-(1-pyrrolidin-2-ylpropan-2-ylamino)acetamide
CID 79544229
4-methoxy-N-(1-pyrrolidin-2-ylpropan-2-yl)butan-1-amine
CID 79541172
N-(2-cyclopentyloxyethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79539845
N-(3-ethoxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541660
N-[2-(4-methylpiperazin-1-yl)ethyl]-1-pyrrolidin-2-ylpropan-2-amine
CID 79539939
N-(2,2-dicyclopropylethyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541769

Frequently Asked Questions

What is the IUPAC name of N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine (CID 79540795) is N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine is CC(CC1CCCN1)NCCN.
What is the InChIKey of N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine?
The InChIKey is YOLQEIVLNHZHCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-8(11-6-4-10)7-9-3-2-5-12-9/h8-9,11-12H,2-7,10H2,1H3.
What are the key properties of N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine?
N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine has a molecular weight of 171.29 g/mol, XLogP of 0.07, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-pyrrolidin-2-ylpropan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 79540795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).