2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine

C11H24N2 — CID 63880301

IUPAC2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine
SMILESCNC(C)C(C)N(C)CC1CC1C
InChIInChI=1S/C11H24N2/c1-8-6-11(8)7-13(5)10(3)9(2)12-4/h8-12H,6-7H2,1-5H3
InChIKeySEQMPAVLHGZCQR-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.57
Rot. Bonds5

About 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine

2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine (PubChem CID 63880301) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine
PubChem CID63880301
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine
SMILESCNC(C)C(C)N(C)CC1CC1C
InChIInChI=1S/C11H24N2/c1-8-6-11(8)7-13(5)10(3)9(2)12-4/h8-12H,6-7H2,1-5H3
InChIKeySEQMPAVLHGZCQR-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine?
The IUPAC name of 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine (CID 63880301) is 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine.
What is the SMILES notation for 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine?
The canonical SMILES for 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine is CNC(C)C(C)N(C)CC1CC1C.
What is the InChIKey of 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine?
The InChIKey is SEQMPAVLHGZCQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-8-6-11(8)7-13(5)10(3)9(2)12-4/h8-12H,6-7H2,1-5H3.
What are the key properties of 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine?
2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-dimethyl-3-N-[(2-methylcyclopropyl)methyl]butane-2,3-diamine is sourced from PubChem (CID 63880301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).