(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine

C10H24N2 — CID 103934564

IUPAC(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine
SMILESCC(C)CN(C[C@H](C)N)C(C)C
InChIInChI=1S/C10H24N2/c1-8(2)6-12(9(3)4)7-10(5)11/h8-10H,6-7,11H2,1-5H3/t10-/m0/s1
InChIKeyXIPURADGUFEKKN-JTQLQIEISA-N
MW172.32 g/mol
LogP1.70
Rot. Bonds5

About (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine

(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine (PubChem CID 103934564) has the molecular formula C10H24N2 and a molecular weight of 172.32 g/mol. Its IUPAC name is (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine.

Molecular Properties

Compound Name(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine
PubChem CID103934564
Molecular FormulaC10H24N2
Molecular Weight172.32 g/mol
Exact Mass172.19
IUPAC Name(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine
SMILESCC(C)CN(C[C@H](C)N)C(C)C
InChIInChI=1S/C10H24N2/c1-8(2)6-12(9(3)4)7-10(5)11/h8-10H,6-7,11H2,1-5H3/t10-/m0/s1
InChIKeyXIPURADGUFEKKN-JTQLQIEISA-N
XLogP1.70
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.32
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(2-methylpropyl)-1-N-pentan-3-ylpropane-1,2-diamine
CID 79484278
(2R)-1-N-propan-2-yl-1-N-propylpropane-1,2-diamine
CID 103934466
1-N-(2-aminopropyl)-1-N-(2-methylpropyl)propane-1,2-diamine
CID 18411129
(2R)-1-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine
CID 103934791
[2-methylpropyl(propan-2-yl)amino]methanol
CID 54030512
1-N-(2-methylpropyl)-1-N-phosphanylpropane-1,2-diamine
CID 145321212
N-(cyclobutylmethyl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 121474434
2-N-methyl-1-N-(2-methylpropyl)-1-N-propan-2-ylbutane-1,2-diamine
CID 62039501
2-N,2-N-bis(2-methylpropyl)propane-1,2-diamine
CID 61377871
3-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
CID 60946125
(2R)-1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethylpropane-1,2-diamine
CID 103188351
1-N-[1-(dimethylamino)propan-2-yl]-1-N-ethylpropane-1,2-diamine
CID 103188353

Frequently Asked Questions

What is the IUPAC name of (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine?
The IUPAC name of (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine (CID 103934564) is (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine.
What is the SMILES notation for (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine?
The canonical SMILES for (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine is CC(C)CN(C[C@H](C)N)C(C)C.
What is the InChIKey of (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine?
The InChIKey is XIPURADGUFEKKN-JTQLQIEISA-N. The full InChI is InChI=1S/C10H24N2/c1-8(2)6-12(9(3)4)7-10(5)11/h8-10H,6-7,11H2,1-5H3/t10-/m0/s1.
What are the key properties of (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine?
(2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine has a molecular weight of 172.32 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-N-(2-methylpropyl)-1-N-propan-2-ylpropane-1,2-diamine is sourced from PubChem (CID 103934564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).