N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine

C12H24N2 — CID 61480803

IUPACN'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine
SMILESCC(C)NCCNC(C1CC1)C1CC1
InChIInChI=1S/C12H24N2/c1-9(2)13-7-8-14-12(10-3-4-10)11-5-6-11/h9-14H,3-8H2,1-2H3
InChIKeyACIBHTFANIKHEE-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.76
Rot. Bonds7

About N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine

N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine (PubChem CID 61480803) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine
PubChem CID61480803
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine
SMILESCC(C)NCCNC(C1CC1)C1CC1
InChIInChI=1S/C12H24N2/c1-9(2)13-7-8-14-12(10-3-4-10)11-5-6-11/h9-14H,3-8H2,1-2H3
InChIKeyACIBHTFANIKHEE-UHFFFAOYSA-N
XLogP1.76
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(Dicyclopropylmethyl)(methyl)amine
CID 16788204
N-(dicyclopropylmethyl)propan-1-amine
CID 19063910
N'-(dicyclopropylmethyl)-N'-methylethane-1,2-diamine
CID 86775693
1,1-dicyclopropyl-N-(dicyclopropylmethyl)methanamine
CID 43362840
N'-cyclopropyl-N-(dicyclopropylmethyl)-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62554001
N-(dicyclopropylmethyl)-N'-propan-2-yl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62555313
N-(dicyclopropylmethyl)-N'-propyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62555487
N-(dicyclopropylmethyl)-N'-ethyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62556125
N-(dicyclopropylmethyl)-N'-methyl-N'-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 62560287
N-(dicyclopropylmethyl)-N'-methyl-N'-(3,3,3-trifluoropropyl)ethane-1,2-diamine
CID 65529974
N'-(dicyclopropylmethyl)-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 79261544
N-(dicyclopropylmethyl)-2-fluoroethanamine
CID 80602591

Frequently Asked Questions

What is the IUPAC name of N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine?
The IUPAC name of N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine (CID 61480803) is N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine.
What is the SMILES notation for N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine?
The canonical SMILES for N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine is CC(C)NCCNC(C1CC1)C1CC1.
What is the InChIKey of N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine?
The InChIKey is ACIBHTFANIKHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9(2)13-7-8-14-12(10-3-4-10)11-5-6-11/h9-14H,3-8H2,1-2H3.
What are the key properties of N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine?
N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine has a molecular weight of 196.34 g/mol, XLogP of 1.76, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(dicyclopropylmethyl)-N-propan-2-ylethane-1,2-diamine is sourced from PubChem (CID 61480803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).