N,N-bis(propan-2-ylamino)ethanamine

C8H21N3 — CID 56989982

IUPACN,N-bis(propan-2-ylamino)ethanamine
SMILESCCN(NC(C)C)NC(C)C
InChIInChI=1S/C8H21N3/c1-6-11(9-7(2)3)10-8(4)5/h7-10H,6H2,1-5H3
InChIKeyNGRXSVVLBWDAHG-UHFFFAOYSA-N
MW159.28 g/mol
LogP1.13
Rot. Bonds5

About N,N-bis(propan-2-ylamino)ethanamine

N,N-bis(propan-2-ylamino)ethanamine (PubChem CID 56989982) has the molecular formula C8H21N3 and a molecular weight of 159.28 g/mol. Its IUPAC name is N,N-bis(propan-2-ylamino)ethanamine.

Molecular Properties

Compound NameN,N-bis(propan-2-ylamino)ethanamine
PubChem CID56989982
Molecular FormulaC8H21N3
Molecular Weight159.28 g/mol
Exact Mass159.17
IUPAC NameN,N-bis(propan-2-ylamino)ethanamine
SMILESCCN(NC(C)C)NC(C)C
InChIInChI=1S/C8H21N3/c1-6-11(9-7(2)3)10-8(4)5/h7-10H,6H2,1-5H3
InChIKeyNGRXSVVLBWDAHG-UHFFFAOYSA-N
XLogP1.13
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.28
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-Isopropylhydrazine
CID 52789
1,2-Diisopropylhydrazine
CID 77304
Hydrazine, 1,2-diethyl-
CID 74171
n,n'-Dibutylhydrazine
CID 74454
sec-Butylhydrazine
CID 547690
Hydrazine, 1,2-di-sec-butyl-
CID 278540
(1-Methylpropyl)-hydrazine hydrochloride (1:1)
CID 43819151
1-Methyl-3-isopropyltriazene
CID 147249
1-Triazene, 1,3-bis(1-methylethyl)-
CID 150088
1-Isopropyl-2-propylhydrazine
CID 542517
Tri-isopropylhydrazin
CID 20492895
1,1-Diethyl-2-sec-butylhydrazine
CID 560118

Frequently Asked Questions

What is the IUPAC name of N,N-bis(propan-2-ylamino)ethanamine?
The IUPAC name of N,N-bis(propan-2-ylamino)ethanamine (CID 56989982) is N,N-bis(propan-2-ylamino)ethanamine.
What is the SMILES notation for N,N-bis(propan-2-ylamino)ethanamine?
The canonical SMILES for N,N-bis(propan-2-ylamino)ethanamine is CCN(NC(C)C)NC(C)C.
What is the InChIKey of N,N-bis(propan-2-ylamino)ethanamine?
The InChIKey is NGRXSVVLBWDAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3/c1-6-11(9-7(2)3)10-8(4)5/h7-10H,6H2,1-5H3.
What are the key properties of N,N-bis(propan-2-ylamino)ethanamine?
N,N-bis(propan-2-ylamino)ethanamine has a molecular weight of 159.28 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(propan-2-ylamino)ethanamine is sourced from PubChem (CID 56989982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).